AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-40

SMILES stringlengths 2 959	IUPAC stringlengths 6 1.64k
COc1cc(O)c2c(c1)C(C)(C(C)O)OC2=O	7-hydroxy-3-(1-hydroxyethyl)-5-methoxy-3-methyl-2-benzofuran-1-one
COC(=O)c1cc(OC)ccc1NC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1	methyl 2-[[3-(furan-2-carbonylamino)-4-methylbenzoyl]amino]-5-methoxybenzoate
COc1ccc(Oc2ccc3c(c2)CC[C@@H]2[C@H]3CCCN2C(=O)c2ccc3nc[nH]c3c2)cc1	[(4aR,10bS)-8-(4-methoxyphenoxy)-2,3,4a,5,6,10b-hexahydro-1H-benzo[f]quinolin-4-yl]-(3H-benzimidazol-5-yl)methanone
CC(=O)Nc1ccc(S(=O)(=O)NCC2CCN(c3ccccc3)C2)cc1	N-[4-[(1-phenylpyrrolidin-3-yl)methylsulfamoyl]phenyl]acetamide
O=C(O)CCC(=O)N1CCOC(CO)C1	4-[2-(hydroxymethyl)morpholin-4-yl]-4-oxobutanoic acid
CCC(C)C1NC(=O)C(C)(C)N(Cc2cc(Br)cs2)C1=O	1-[(4-bromothiophen-2-yl)methyl]-3-butan-2-yl-6,6-dimethylpiperazine-2,5-dione
COC(=O)C(C)NC1CCCc2cc(OC)ccc21	methyl 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propanoate
O=C(O)c1ccc(-c2ccc(C=C3C(=O)N(c4ccccc4)N=C3C(F)(F)F)o2)cc1	4-[5-[[5-oxo-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]methyl]furan-2-yl]benzoic acid
CC(N[C@H](C)c1ccc(Br)cc1)c1ccc(F)cn1	(1R)-1-(4-bromophenyl)-N-[1-(5-fluoropyridin-2-yl)ethyl]ethanamine
CC(=O)N1Cc2cc3c(cc2CC1C)OCO3	1-(7-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-yl)ethanone
CO[C@@H](C(C)C)[C@@H](O)c1c(C)cccc1Cl	(1S,2S)-1-(2-chloro-6-methylphenyl)-2-methoxy-3-methylbutan-1-ol
CC(/C=C/C=C(C)/C=C/C1=CC[C@@H](O)CC1(C)C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C1=CC[C@H](O)CC1(C)C	(1S)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-6,6-dimethylcyclohexen-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-5,5-dimethylcyclohex-3-en-1-ol
c1ccc(CC2=C(C3CCN(Cc4ccncc4)CC3)NNN2)cc1	4-[[4-(5-benzyl-2,3-dihydro-1H-triazol-4-yl)piperidin-1-yl]methyl]pyridine
CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC(COC(=O)CCCCC/C=C\C/C=C\C/C=C\CC)COC(=O)CCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC	[2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxypropyl] (17Z,20Z,23Z,26Z,29Z)-dotriaconta-17,20,23,26,29-pentaenoate
Cc1nccc(C(Cc2ccc(F)cc2C)NN)n1	[2-(4-fluoro-2-methylphenyl)-1-(2-methylpyrimidin-4-yl)ethyl]hydrazine
COc1ccc(C2=NN(C(=O)CN3CCN(C)CC3)C(c3ccccc3C)C2)c(OC)c1	1-[5-(2,4-dimethoxyphenyl)-3-(2-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-(4-methylpiperazin-1-yl)ethanone
COC(CCCCCO/C=C/CB1OC(C)(C)C(C)(C)O1)OC	2-[(E)-3-(6,6-dimethoxyhexoxy)prop-2-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Cc1cccnc1C1CCCC(c2cn3c(N4CCN(C)CC4)cccc3n2)N1	5-(4-methylpiperazin-1-yl)-2-[6-(3-methylpyridin-2-yl)piperidin-2-yl]imidazo[1,2-a]pyridine
COC(=O)C(C)N1CC2CCCC(N)C2C1	methyl 2-(4-amino-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)propanoate
CNc1nc2[nH]c(-c3ccc(F)cc3)cc2c2c1ncn2C	11-(4-fluorophenyl)-N,3-dimethyl-3,5,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-1,4,6,8,11-pentaen-7-amine
[2H]B(P)S.[3H]OCCC[C@H]1C[C@H](CCC)[C@H](Oc2nc(C)nc(C)c2[N+](=O)[O-])[C@@H]1O	deuterio(phosphanyl)borinothioic acid;(1R,2S,3S,5S)-2-(2,6-dimethyl-5-nitropyrimidin-4-yl)oxy-3-propyl-5-(3-tritiooxypropyl)cyclopentan-1-ol
CCn1nccc1CNCC(O)CC(C)(C)C	1-[(2-ethylpyrazol-3-yl)methylamino]-4,4-dimethylpentan-2-ol
CC(C)CC(C)(N)COc1ccc(-c2ccnnc2)cc1Cl	1-(2-chloro-4-pyridazin-4-ylphenoxy)-2,4-dimethylpentan-2-amine
COc1ccccc1-c1ccccc1S(=O)(=O)Cl	2-(2-methoxyphenyl)benzenesulfonyl chloride
CCC(N)c1cn(Cc2nnc(C)n2C)nn1	1-[1-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]triazol-4-yl]propan-1-amine
Cc1ccc(N)cc1C(=O)N1CCC(Cc2ccccc2)CC1.Cl	(5-amino-2-methylphenyl)-(4-benzylpiperidin-1-yl)methanone;hydrochloride
CC1(C2CC2)NC(=O)N(CC(=O)N2CCN(C(=O)CCCc3ccccc3)CC2)C1=O	5-cyclopropyl-5-methyl-3-[2-oxo-2-[4-(4-phenylbutanoyl)piperazin-1-yl]ethyl]imidazolidine-2,4-dione
CNCc1nc(-c2ccc(Br)cc2)n2c1CCCC2	1-[3-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]-N-methylmethanamine
O=C(C=Cc1ccc(OCC2CO2)c(F)c1)Oc1ccc(OC(=O)C=Cc2ccc(OCC3CO3)c(F)c2)c(C(F)(F)F)c1C(F)(F)F	[4-[3-[3-fluoro-4-(oxiran-2-ylmethoxy)phenyl]prop-2-enoyloxy]-2,3-bis(trifluoromethyl)phenyl] 3-[3-fluoro-4-(oxiran-2-ylmethoxy)phenyl]prop-2-enoate
C[C@@]1(CO)[C@H](O)CC[C@@]2(C)C(CCC3=CCOC3=O)=C(CNC34CC5CC(CC(C5)C3)C4)CC[C@H]12	4-[2-[(4aS,5R,6R,8aR)-2-[(1-adamantylamino)methyl]-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]ethyl]-2H-furan-5-one
CC(C)c1ccc2c(c1)sc(=NC(=O)c1ccc(N3C(=O)CCC3=O)cc1)n2C	4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-6-propan-2-yl-1,3-benzothiazol-2-ylidene)benzamide
CCCCCCCCCCCCSCCCNCC(=O)Nc1ccc(-c2ccc(NC(=O)CNCCCSCCCCCCCCCCCC)c3c2C(=O)c2ccccc2C3=O)c2c1C(=O)c1ccccc1C2=O	2-(3-dodecylsulfanylpropylamino)-N-[4-[4-[[2-(3-dodecylsulfanylpropylamino)acetyl]amino]-9,10-dioxoanthracen-1-yl]-9,10-dioxoanthracen-1-yl]acetamide
CCNC(=NCC(C)Oc1ccccc1C)NC1CC2CCC1O2.I	1-ethyl-2-[2-(2-methylphenoxy)propyl]-3-(7-oxabicyclo[2.2.1]heptan-2-yl)guanidine;hydroiodide
CCc1ccccc1O[C@@H](C)C(=O)Nc1ccc(C)cc1	(2S)-2-(2-ethylphenoxy)-N-(4-methylphenyl)propanamide
N=C(N)c1ccc2cc(C(=O)O)n(Cc3c[nH]c4ccccc34)c2n1	6-carbamimidoyl-1-(1H-indol-3-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylic acid
CC(C)(C)OC(=O)N[C@H]1CCCCCC=CC2C[C@@]2(C(=O)O)NC(=O)[C@@H]2C[C@@H](n3ncc(N4CCCC4)c(-c4ccsc4)c3=O)CN2C1=O	(1S,4R,14S,18R)-14-[(2-methylpropan-2-yl)oxycarbonylamino]-2,15-dioxo-18-(6-oxo-4-pyrrolidin-1-yl-5-thiophen-3-ylpyridazin-1-yl)-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid
CCCCCc1cc(C)ccc1OC(CC)C(=O)Nc1cc(O)c(NC(C)=O)cc1Cl	N-(4-acetamido-2-chloro-5-hydroxyphenyl)-2-(4-methyl-2-pentylphenoxy)butanamide
COC[C@H]1CCCN1c1cc(C)nc2cc(Nc3ccc(C#N)cc3)ccc12	4-[[4-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]-2-methylquinolin-7-yl]amino]benzonitrile
CC(C)=CCOc1ccc(OC(C)CO)cc1	2-[4-(3-methylbut-2-enoxy)phenoxy]propan-1-ol
CCC1OC(OCCCCC(=O)NCCCC[C@H](NC(=O)CCCCOC2OC(CC)C(C)C(C)C2NC(C)=O)C(=O)NCCNC(=O)c2cc(OCCCCCNC(=O)CCCCCCCCCCC(=O)O)cc(C(=O)NCCNC(=O)[C@H](CCCCNC(=O)CCCCOC3OC(CC)C(C)C(C)C3NC(C)=O)NC(=O)CCCCOC3OC(CC)C(C)C(C)C3NC(C)=O)c2)C(NC(C)=O)C(C)C1C	12-[5-[3,5-bis[2-[[(2S)-2,6-bis[5-(3-acetamido-6-ethyl-4,5-dimethyloxan-2-yl)oxypentanoylamino]hexanoyl]amino]ethylcarbamoyl]phenoxy]pentylamino]-12-oxododecanoic acid
O=C(CNC12CC3CC(CC(O)(C3)C1)C2)Nc1cccc(O)c1	2-[(3-hydroxy-1-adamantyl)amino]-N-(3-hydroxyphenyl)acetamide
Nc1cccc(N2CCc3cc(-c4ccc5c(c4)CCN5c4cccc(N)c4)ccc32)c1	3-[5-[1-(3-aminophenyl)-2,3-dihydroindol-5-yl]-2,3-dihydroindol-1-yl]aniline
CCN(Cc1ccccc1)c1ccc(Cl)c(CCl)n1	N-benzyl-5-chloro-6-(chloromethyl)-N-ethylpyridin-2-amine
CC(NC(=O)CC1COCCN1)c1ccc(F)c(F)c1.Cl	N-[1-(3,4-difluorophenyl)ethyl]-2-morpholin-3-ylacetamide;hydrochloride
CCN1CCCC1COc1nc2c(c(N3CCN(C(=O)C=CCN(C)C)C(CC#N)C3)n1)CCC(N1CCCc3ccccc31)C2	2-[4-[7-(3,4-dihydro-2H-quinolin-1-yl)-2-[(1-ethylpyrrolidin-2-yl)methoxy]-5,6,7,8-tetrahydroquinazolin-4-yl]-1-[4-(dimethylamino)but-2-enoyl]piperazin-2-yl]acetonitrile
Cc1cc2cc(CCNC(=O)C3CCCC3)c(=O)[nH]c2cc1C	N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]cyclopentanecarboxamide
CN1CCN(CCCc2ccccc2)C[C@H](C(N)=O)C1	(6R)-1-methyl-4-(3-phenylpropyl)-1,4-diazepane-6-carboxamide
CCCNCc1nnc(-c2csnn2)o1	N-[[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine
O=C(OCc1nnc(-c2ccc(Br)s2)o1)c1ccc(CN2C(=O)CNC2=O)cc1	[5-(5-bromothiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl 4-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate
COc1cccc2c(OC)c(CC(C)C(=O)O)ccc12	3-(1,5-dimethoxynaphthalen-2-yl)-2-methylpropanoic acid
Cc1c(C(=O)NCCNC(=O)c2ccco2)sc2cccc(F)c12	N-[2-[(4-fluoro-3-methyl-1-benzothiophene-2-carbonyl)amino]ethyl]furan-2-carboxamide
Cc1cc(Cl)cnc1C1CCN(C(=O)OC(C)(C)C)CC1	tert-butyl 4-(5-chloro-3-methylpyridin-2-yl)piperidine-1-carboxylate
CC(C)Cn1cc(-c2cccc([C@H](NC(=O)c3cccc(C(F)(F)F)c3Cl)[C@@H]3CCCCN3)c2)cn1	2-chloro-N-[(S)-[3-[1-(2-methylpropyl)pyrazol-4-yl]phenyl]-[(2S)-piperidin-2-yl]methyl]-3-(trifluoromethyl)benzamide
CC(C(=O)NCc1ccc(C(=O)NCC(N)=O)cc1)C(N)c1ccccc1.Cl	4-[[(3-amino-2-methyl-3-phenylpropanoyl)amino]methyl]-N-(2-amino-2-oxoethyl)benzamide;hydrochloride
COc1cc(CO)cc(I)c1OC1C=C(C(=O)NCCO)CC(N(Cc2ccc3c(c2)OCO3)C(=O)C2CCCC2)C1O	5-[1,3-benzodioxol-5-ylmethyl(cyclopentanecarbonyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-[4-(hydroxymethyl)-2-iodo-6-methoxyphenoxy]cyclohexene-1-carboxamide
COc1ccc([C@@H]2[C@H](C(=O)Nc3ccccc3)[C@@H](C)Nc3nc(SC)nn32)cc1	(5R,6R,7S)-7-(4-methoxyphenyl)-5-methyl-2-methylsulfanyl-N-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Cl.N#Cc1cnc2ccc(Cl)cc2c1Nc1ccccc1	4-anilino-6-chloroquinoline-3-carbonitrile;hydrochloride
COc1ccc(N=CC2C(=O)N3C=CC=C(C)C3=NC2=NCCO)cc1	2-(2-hydroxyethylimino)-3-[(4-methoxyphenyl)iminomethyl]-9-methylpyrido[1,2-a]pyrimidin-4-one
C=C1C(O)CC2C3C(CCC12C)c1ccc(O)cc1C(F)C3CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F	6-fluoro-13-methyl-17-methylidene-7-[9-(4,4,5,5,5-pentafluoropentylsulfinyl)nonyl]-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,16-diol
CCc1ccc(NC(=O)CCCn2nc(C)c3sc4ccccc4c3c2=O)cc1	N-(4-ethylphenyl)-4-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide
CN=[C-]c1cc(C)c(C)cc1C.[CH3-].[Y]	carbanide;N-methyl-1-(2,4,5-trimethylphenyl)methanimine;yttrium
COc1cccc(NC(=O)C(=O)NCc2ccccc2)c1	N-benzyl-N'-(3-methoxyphenyl)oxamide
CC(=O)NCC=Cc1nn(C)cc1Cl	N-[3-(4-chloro-1-methylpyrazol-3-yl)prop-2-enyl]acetamide
C[C@](O)(c1ccc(S(=O)(=O)c2ccc(C#N)cc2CC2CC2)cc1)C(F)(F)F	3-(cyclopropylmethyl)-4-[4-[(2S)-1,1,1-trifluoro-2-hydroxypropan-2-yl]phenyl]sulfonylbenzonitrile
CNC(=O)C(C)NS(=O)(=O)c1cc(C)cc(N)c1C	2-[(3-amino-2,5-dimethylphenyl)sulfonylamino]-N-methylpropanamide
Nc1cc(NS(=O)(=O)CCS(=O)(=O)O)ccc1O	2-[(3-amino-4-hydroxyphenyl)sulfamoyl]ethanesulfonic acid
CC(=O)N(C)c1ccccc1NC(=O)CCC(=O)C(C)C	N-[2-[acetyl(methyl)amino]phenyl]-5-methyl-4-oxohexanamide
CC(C)CCN(C)C(=O)C(N)CC(=O)O	3-amino-4-[methyl(3-methylbutyl)amino]-4-oxobutanoic acid
CO/N=C/c1ccc(-c2noc(C(F)(F)Cl)n2)cc1	(E)-1-[4-[5-[chloro(difluoro)methyl]-1,2,4-oxadiazol-3-yl]phenyl]-N-methoxymethanimine
OCC(CO)CC1=C(c2cnn(C(F)F)c2)CN=C(c2nccs2)N1	2-[[5-[1-(difluoromethyl)pyrazol-4-yl]-2-(1,3-thiazol-2-yl)-1,4-dihydropyrimidin-6-yl]methyl]propane-1,3-diol
CC1C(C(=O)O)CCN1c1ccc(C#N)cn1	1-(5-cyanopyridin-2-yl)-2-methylpyrrolidine-3-carboxylic acid
Cl.O=S(=O)(c1cccs1)N1CCC2(CC1)NCCN=C2NCc1ccc(F)c(Cl)c1	N-[(3-chloro-4-fluorophenyl)methyl]-9-thiophen-2-ylsulfonyl-1,4,9-triazaspiro[5.5]undec-4-en-5-amine;hydrochloride
CC1(C)c2cc(N(c3ccc(-c4ccc5ccccc5c4-c4ccccc4)cc3)c3ccc(C45CC6CC(CC(C6)C4)C5)cc3)ccc2-c2c(C3CCCCC3)cccc21	N-[4-(1-adamantyl)phenyl]-5-cyclohexyl-9,9-dimethyl-N-[4-(1-phenylnaphthalen-2-yl)phenyl]fluoren-2-amine
CN(C)Cc1ccc(C(=O)Nc2nn[nH]n2)cc1	4-[(dimethylamino)methyl]-N-(2H-tetrazol-5-yl)benzamide
CC(CC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O)c1ccccc1	N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-phenylbutanamide
CC(C)(O)C#Cc1ccc2c(c1)-n1nnnc1[C@@H](NC(=O)c1n[nH]c(Cc3ccccc3)n1)CO2	5-benzyl-N-[(4R)-9-(3-hydroxy-3-methylbut-1-ynyl)-4,5-dihydrotetrazolo[5,1-d][1,5]benzoxazepin-4-yl]-1H-1,2,4-triazole-3-carboxamide
Cn1cccc1C1CC(C(=O)N2CCCCC2c2ccc(F)cc2)NN1	[2-(4-fluorophenyl)piperidin-1-yl]-[5-(1-methylpyrrol-2-yl)pyrazolidin-3-yl]methanone
CCOC(=O)C1=C(C)N=C2C[C@H](c3cccc(OC)c3)[C@H](C(=O)OCC)C(=O)C2[C@@H]1c1cc(C)sc1C	diethyl (4S,6S,7S)-4-(2,5-dimethylthiophen-3-yl)-7-(3-methoxyphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3,6-dicarboxylate
CC1CCC(F)(c2cscn2)CN1	4-(3-fluoro-6-methylpiperidin-3-yl)-1,3-thiazole
CCOC(=O)c1ccc2c(C(=Nc3ccc(N(CCN(C)C)C(=O)Cc4ccccc4)cc3)c3ccccc3)c(O)[nH]c2c1	ethyl 3-[N-[4-[2-(dimethylamino)ethyl-(2-phenylacetyl)amino]phenyl]-C-phenylcarbonimidoyl]-2-hydroxy-1H-indole-6-carboxylate
C[C@H]1CN([C@@H](C)CO)S(=O)(=O)c2ccc(C#Cc3ccccc3)cc2O[C@@H]1CN(C)C(=O)CN(C)C	2-(dimethylamino)-N-[[(4S,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-phenylethynyl)-4,5-dihydro-3H-6,1λ6,2-benzoxathiazocin-5-yl]methyl]-N-methylacetamide
NC(=O)NCCCC[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O	(2S)-6-(carbamoylamino)-2-(2,4-dinitroanilino)hexanoic acid
Cc1cc(OCC2CCCCN2C)c(CO)cn1	[6-methyl-4-[(1-methylpiperidin-2-yl)methoxy]pyridin-3-yl]methanol
CCCCCCCCCCCCCCCC(=O)NCCBr	N-(2-bromoethyl)hexadecanamide
CCOc1cc(/C=C2/NC(=O)N(CC(=O)Nc3cccc(C)c3)C2=O)cc(Br)c1OCc1ccc(I)cc1	2-[(4E)-4-[[3-bromo-5-ethoxy-4-[(4-iodophenyl)methoxy]phenyl]methylidene]-2,5-dioxoimidazolidin-1-yl]-N-(3-methylphenyl)acetamide
CN1CCN(c2ncc(CN3CCc4[nH]c(=S)[nH]c(=O)c4C3)s2)CC1	6-[[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]methyl]-2-sulfanylidene-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
COC[C@H]1CCCN(C(=O)Cc2c(Cl)cccc2OC)C1	2-(2-chloro-6-methoxyphenyl)-1-[(3S)-3-(methoxymethyl)piperidin-1-yl]ethanone
O=C(Nc1nccs1)C(CC1CCCC1)c1ccc(S(=O)(=O)N2C=C3C=CC=CC3N2)cc1	2-[4-(1,7a-dihydroindazol-2-ylsulfonyl)phenyl]-3-cyclopentyl-N-(1,3-thiazol-2-yl)propanamide
CCC(=O)N1CCC(C2OCCO2)CC1	1-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-one
CCNC(=NCC1CC(=O)Nc2ccccc21)NCCn1ccnc1	1-ethyl-3-(2-imidazol-1-ylethyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-4-yl)methyl]guanidine
CCN1C=CC(/C=C/c2ccccc2N(C)CCSS)=CC1	N-[2-(disulfanyl)ethyl]-2-[(E)-2-(1-ethyl-2H-pyridin-4-yl)ethenyl]-N-methylaniline
COCOc1cc2c(c(OCOC)c1)C(=O)O[C@@H](C)CCCC(=O)[C@H]1OC(C)(C)O[C@H]1C/C=C/2	(2E,5S,9S,14S)-18,20-bis(methoxymethoxy)-7,7,14-trimethyl-6,8,15-trioxatricyclo[15.4.0.05,9]henicosa-1(17),2,18,20-tetraene-10,16-dione
CN(C)C(=O)c1cccc([N-]C2=C(N[C@@H](c3ccc(F)cc3)C3CC3)C(O)C2=O)c1O.[Li+]	lithium;[2-[[(R)-cyclopropyl-(4-fluorophenyl)methyl]amino]-3-hydroxy-4-oxocyclobuten-1-yl]-[3-(dimethylcarbamoyl)-2-hydroxyphenyl]azanide
CCOC(=O)c1c(NC(=O)COC(=O)[C@H]2CCCO2)sc(C(=O)NC)c1C	[2-[[3-ethoxycarbonyl-4-methyl-5-(methylcarbamoyl)thiophen-2-yl]amino]-2-oxoethyl] (2R)-oxolane-2-carboxylate
CCNC(=NCc1ccc(COCC(F)(F)F)cc1)NCCNC(=O)c1ccccc1	N-[2-[[N-ethyl-N'-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]carbamimidoyl]amino]ethyl]benzamide
O=C(O)NCCCC[C@H](NS(=O)(=O)c1cccs1)C(=O)N(CCc1cccs1)CCc1cccs1	[(5S)-6-[bis(2-thiophen-2-ylethyl)amino]-6-oxo-5-(thiophen-2-ylsulfonylamino)hexyl]carbamic acid
CC(CCc1ccccc1)NS(=O)(=O)c1ccc(F)cc1F	2,4-difluoro-N-(4-phenylbutan-2-yl)benzenesulfonamide
C1COCCOCCOCCOCCOCCO1.C=C.N.O=S(=O)([O-])C(F)(F)F.Oc1cccc(Cl)n1.Oc1cccc(Cl)n1.Oc1cccc(Cl)n1.Oc1cccc(Cl)n1.[Ru+].[Ru]	azane;6-chloropyridin-2-ol;ethene;1,4,7,10,13,16-hexaoxacyclooctadecane;ruthenium;ruthenium(1+);trifluoromethanesulfonate
CN(C)c1ccc(C=NNC(=O)C(=Cc2cccs2)NC(=O)c2ccccc2)cc1	N-[3-[2-[[4-(dimethylamino)phenyl]methylidene]hydrazinyl]-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide
COc1ccc(S(=O)(=O)N2C(=O)C[C@H](c3ccccc3)[C@@H]2c2cccc(OC)c2)cc1	(4R,5R)-5-(3-methoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-4-phenylpyrrolidin-2-one

COc1cc(O)c2c(c1)C(C)(C(C)O)OC2=O

7-hydroxy-3-(1-hydroxyethyl)-5-methoxy-3-methyl-2-benzofuran-1-one

COC(=O)c1cc(OC)ccc1NC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1

methyl 2-[[3-(furan-2-carbonylamino)-4-methylbenzoyl]amino]-5-methoxybenzoate

COc1ccc(Oc2ccc3c(c2)CC[C@@H]2[C@H]3CCCN2C(=O)c2ccc3nc[nH]c3c2)cc1

[(4aR,10bS)-8-(4-methoxyphenoxy)-2,3,4a,5,6,10b-hexahydro-1H-benzo[f]quinolin-4-yl]-(3H-benzimidazol-5-yl)methanone

CC(=O)Nc1ccc(S(=O)(=O)NCC2CCN(c3ccccc3)C2)cc1

N-[4-[(1-phenylpyrrolidin-3-yl)methylsulfamoyl]phenyl]acetamide

O=C(O)CCC(=O)N1CCOC(CO)C1

4-[2-(hydroxymethyl)morpholin-4-yl]-4-oxobutanoic acid

CCC(C)C1NC(=O)C(C)(C)N(Cc2cc(Br)cs2)C1=O

1-[(4-bromothiophen-2-yl)methyl]-3-butan-2-yl-6,6-dimethylpiperazine-2,5-dione

COC(=O)C(C)NC1CCCc2cc(OC)ccc21

methyl 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propanoate

O=C(O)c1ccc(-c2ccc(C=C3C(=O)N(c4ccccc4)N=C3C(F)(F)F)o2)cc1

4-[5-[[5-oxo-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]methyl]furan-2-yl]benzoic acid

CC(N[C@H](C)c1ccc(Br)cc1)c1ccc(F)cn1

(1R)-1-(4-bromophenyl)-N-[1-(5-fluoropyridin-2-yl)ethyl]ethanamine

CC(=O)N1Cc2cc3c(cc2CC1C)OCO3

1-(7-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-yl)ethanone

CO[C@@H](C(C)C)[C@@H](O)c1c(C)cccc1Cl

(1S,2S)-1-(2-chloro-6-methylphenyl)-2-methoxy-3-methylbutan-1-ol

CC(/C=C/C=C(C)/C=C/C1=CC[C@@H](O)CC1(C)C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C1=CC[C@H](O)CC1(C)C

(1S)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-6,6-dimethylcyclohexen-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-5,5-dimethylcyclohex-3-en-1-ol

c1ccc(CC2=C(C3CCN(Cc4ccncc4)CC3)NNN2)cc1

4-[[4-(5-benzyl-2,3-dihydro-1H-triazol-4-yl)piperidin-1-yl]methyl]pyridine

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC(COC(=O)CCCCC/C=C\C/C=C\C/C=C\CC)COC(=O)CCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC

[2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxypropyl] (17Z,20Z,23Z,26Z,29Z)-dotriaconta-17,20,23,26,29-pentaenoate

Cc1nccc(C(Cc2ccc(F)cc2C)NN)n1

[2-(4-fluoro-2-methylphenyl)-1-(2-methylpyrimidin-4-yl)ethyl]hydrazine

COc1ccc(C2=NN(C(=O)CN3CCN(C)CC3)C(c3ccccc3C)C2)c(OC)c1

1-[5-(2,4-dimethoxyphenyl)-3-(2-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-(4-methylpiperazin-1-yl)ethanone

COC(CCCCCO/C=C/CB1OC(C)(C)C(C)(C)O1)OC

2-[(E)-3-(6,6-dimethoxyhexoxy)prop-2-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Cc1cccnc1C1CCCC(c2cn3c(N4CCN(C)CC4)cccc3n2)N1

5-(4-methylpiperazin-1-yl)-2-[6-(3-methylpyridin-2-yl)piperidin-2-yl]imidazo[1,2-a]pyridine

COC(=O)C(C)N1CC2CCCC(N)C2C1

methyl 2-(4-amino-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)propanoate

CNc1nc2[nH]c(-c3ccc(F)cc3)cc2c2c1ncn2C

11-(4-fluorophenyl)-N,3-dimethyl-3,5,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-1,4,6,8,11-pentaen-7-amine

[2H]B(P)S.[3H]OCCC[C@H]1C[C@H](CCC)[C@H](Oc2nc(C)nc(C)c2[N+](=O)[O-])[C@@H]1O

deuterio(phosphanyl)borinothioic acid;(1R,2S,3S,5S)-2-(2,6-dimethyl-5-nitropyrimidin-4-yl)oxy-3-propyl-5-(3-tritiooxypropyl)cyclopentan-1-ol

CCn1nccc1CNCC(O)CC(C)(C)C

1-[(2-ethylpyrazol-3-yl)methylamino]-4,4-dimethylpentan-2-ol

CC(C)CC(C)(N)COc1ccc(-c2ccnnc2)cc1Cl

1-(2-chloro-4-pyridazin-4-ylphenoxy)-2,4-dimethylpentan-2-amine

COc1ccccc1-c1ccccc1S(=O)(=O)Cl

2-(2-methoxyphenyl)benzenesulfonyl chloride

CCC(N)c1cn(Cc2nnc(C)n2C)nn1

1-[1-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]triazol-4-yl]propan-1-amine

Cc1ccc(N)cc1C(=O)N1CCC(Cc2ccccc2)CC1.Cl

(5-amino-2-methylphenyl)-(4-benzylpiperidin-1-yl)methanone;hydrochloride

CC1(C2CC2)NC(=O)N(CC(=O)N2CCN(C(=O)CCCc3ccccc3)CC2)C1=O

5-cyclopropyl-5-methyl-3-[2-oxo-2-[4-(4-phenylbutanoyl)piperazin-1-yl]ethyl]imidazolidine-2,4-dione

CNCc1nc(-c2ccc(Br)cc2)n2c1CCCC2

1-[3-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]-N-methylmethanamine

O=C(C=Cc1ccc(OCC2CO2)c(F)c1)Oc1ccc(OC(=O)C=Cc2ccc(OCC3CO3)c(F)c2)c(C(F)(F)F)c1C(F)(F)F

[4-[3-[3-fluoro-4-(oxiran-2-ylmethoxy)phenyl]prop-2-enoyloxy]-2,3-bis(trifluoromethyl)phenyl] 3-[3-fluoro-4-(oxiran-2-ylmethoxy)phenyl]prop-2-enoate

C[C@@]1(CO)[C@H](O)CC[C@@]2(C)C(CCC3=CCOC3=O)=C(CNC34CC5CC(CC(C5)C3)C4)CC[C@H]12

4-[2-[(4aS,5R,6R,8aR)-2-[(1-adamantylamino)methyl]-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]ethyl]-2H-furan-5-one

CC(C)c1ccc2c(c1)sc(=NC(=O)c1ccc(N3C(=O)CCC3=O)cc1)n2C

4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-6-propan-2-yl-1,3-benzothiazol-2-ylidene)benzamide

CCCCCCCCCCCCSCCCNCC(=O)Nc1ccc(-c2ccc(NC(=O)CNCCCSCCCCCCCCCCCC)c3c2C(=O)c2ccccc2C3=O)c2c1C(=O)c1ccccc1C2=O

2-(3-dodecylsulfanylpropylamino)-N-[4-[4-[[2-(3-dodecylsulfanylpropylamino)acetyl]amino]-9,10-dioxoanthracen-1-yl]-9,10-dioxoanthracen-1-yl]acetamide

CCNC(=NCC(C)Oc1ccccc1C)NC1CC2CCC1O2.I

1-ethyl-2-[2-(2-methylphenoxy)propyl]-3-(7-oxabicyclo[2.2.1]heptan-2-yl)guanidine;hydroiodide

CCc1ccccc1O[C@@H](C)C(=O)Nc1ccc(C)cc1

(2S)-2-(2-ethylphenoxy)-N-(4-methylphenyl)propanamide

N=C(N)c1ccc2cc(C(=O)O)n(Cc3c[nH]c4ccccc34)c2n1

6-carbamimidoyl-1-(1H-indol-3-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylic acid

CC(C)(C)OC(=O)N[C@H]1CCCCCC=CC2C[C@@]2(C(=O)O)NC(=O)[C@@H]2C[C@@H](n3ncc(N4CCCC4)c(-c4ccsc4)c3=O)CN2C1=O

(1S,4R,14S,18R)-14-[(2-methylpropan-2-yl)oxycarbonylamino]-2,15-dioxo-18-(6-oxo-4-pyrrolidin-1-yl-5-thiophen-3-ylpyridazin-1-yl)-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid

CCCCCc1cc(C)ccc1OC(CC)C(=O)Nc1cc(O)c(NC(C)=O)cc1Cl

N-(4-acetamido-2-chloro-5-hydroxyphenyl)-2-(4-methyl-2-pentylphenoxy)butanamide

COC[C@H]1CCCN1c1cc(C)nc2cc(Nc3ccc(C#N)cc3)ccc12

4-[[4-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]-2-methylquinolin-7-yl]amino]benzonitrile

CC(C)=CCOc1ccc(OC(C)CO)cc1

2-[4-(3-methylbut-2-enoxy)phenoxy]propan-1-ol

CCC1OC(OCCCCC(=O)NCCCC[C@H](NC(=O)CCCCOC2OC(CC)C(C)C(C)C2NC(C)=O)C(=O)NCCNC(=O)c2cc(OCCCCCNC(=O)CCCCCCCCCCC(=O)O)cc(C(=O)NCCNC(=O)[C@H](CCCCNC(=O)CCCCOC3OC(CC)C(C)C(C)C3NC(C)=O)NC(=O)CCCCOC3OC(CC)C(C)C(C)C3NC(C)=O)c2)C(NC(C)=O)C(C)C1C

12-[5-[3,5-bis[2-[[(2S)-2,6-bis[5-(3-acetamido-6-ethyl-4,5-dimethyloxan-2-yl)oxypentanoylamino]hexanoyl]amino]ethylcarbamoyl]phenoxy]pentylamino]-12-oxododecanoic acid

O=C(CNC12CC3CC(CC(O)(C3)C1)C2)Nc1cccc(O)c1

2-[(3-hydroxy-1-adamantyl)amino]-N-(3-hydroxyphenyl)acetamide

Nc1cccc(N2CCc3cc(-c4ccc5c(c4)CCN5c4cccc(N)c4)ccc32)c1

3-[5-[1-(3-aminophenyl)-2,3-dihydroindol-5-yl]-2,3-dihydroindol-1-yl]aniline

CCN(Cc1ccccc1)c1ccc(Cl)c(CCl)n1

N-benzyl-5-chloro-6-(chloromethyl)-N-ethylpyridin-2-amine

CC(NC(=O)CC1COCCN1)c1ccc(F)c(F)c1.Cl

N-[1-(3,4-difluorophenyl)ethyl]-2-morpholin-3-ylacetamide;hydrochloride

CCN1CCCC1COc1nc2c(c(N3CCN(C(=O)C=CCN(C)C)C(CC#N)C3)n1)CCC(N1CCCc3ccccc31)C2

2-[4-[7-(3,4-dihydro-2H-quinolin-1-yl)-2-[(1-ethylpyrrolidin-2-yl)methoxy]-5,6,7,8-tetrahydroquinazolin-4-yl]-1-[4-(dimethylamino)but-2-enoyl]piperazin-2-yl]acetonitrile

Cc1cc2cc(CCNC(=O)C3CCCC3)c(=O)[nH]c2cc1C

N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]cyclopentanecarboxamide

CN1CCN(CCCc2ccccc2)C[C@H](C(N)=O)C1

(6R)-1-methyl-4-(3-phenylpropyl)-1,4-diazepane-6-carboxamide

CCCNCc1nnc(-c2csnn2)o1

N-[[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine

O=C(OCc1nnc(-c2ccc(Br)s2)o1)c1ccc(CN2C(=O)CNC2=O)cc1

[5-(5-bromothiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl 4-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate

COc1cccc2c(OC)c(CC(C)C(=O)O)ccc12

3-(1,5-dimethoxynaphthalen-2-yl)-2-methylpropanoic acid

Cc1c(C(=O)NCCNC(=O)c2ccco2)sc2cccc(F)c12

N-[2-[(4-fluoro-3-methyl-1-benzothiophene-2-carbonyl)amino]ethyl]furan-2-carboxamide

Cc1cc(Cl)cnc1C1CCN(C(=O)OC(C)(C)C)CC1

tert-butyl 4-(5-chloro-3-methylpyridin-2-yl)piperidine-1-carboxylate

CC(C)Cn1cc(-c2cccc([C@H](NC(=O)c3cccc(C(F)(F)F)c3Cl)[C@@H]3CCCCN3)c2)cn1

2-chloro-N-[(S)-[3-[1-(2-methylpropyl)pyrazol-4-yl]phenyl]-[(2S)-piperidin-2-yl]methyl]-3-(trifluoromethyl)benzamide

CC(C(=O)NCc1ccc(C(=O)NCC(N)=O)cc1)C(N)c1ccccc1.Cl

4-[[(3-amino-2-methyl-3-phenylpropanoyl)amino]methyl]-N-(2-amino-2-oxoethyl)benzamide;hydrochloride

COc1cc(CO)cc(I)c1OC1C=C(C(=O)NCCO)CC(N(Cc2ccc3c(c2)OCO3)C(=O)C2CCCC2)C1O

5-[1,3-benzodioxol-5-ylmethyl(cyclopentanecarbonyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-[4-(hydroxymethyl)-2-iodo-6-methoxyphenoxy]cyclohexene-1-carboxamide

COc1ccc([C@@H]2[C@H](C(=O)Nc3ccccc3)[C@@H](C)Nc3nc(SC)nn32)cc1

(5R,6R,7S)-7-(4-methoxyphenyl)-5-methyl-2-methylsulfanyl-N-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

Cl.N#Cc1cnc2ccc(Cl)cc2c1Nc1ccccc1

4-anilino-6-chloroquinoline-3-carbonitrile;hydrochloride

COc1ccc(N=CC2C(=O)N3C=CC=C(C)C3=NC2=NCCO)cc1

2-(2-hydroxyethylimino)-3-[(4-methoxyphenyl)iminomethyl]-9-methylpyrido[1,2-a]pyrimidin-4-one

C=C1C(O)CC2C3C(CCC12C)c1ccc(O)cc1C(F)C3CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F

6-fluoro-13-methyl-17-methylidene-7-[9-(4,4,5,5,5-pentafluoropentylsulfinyl)nonyl]-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,16-diol

CCc1ccc(NC(=O)CCCn2nc(C)c3sc4ccccc4c3c2=O)cc1

N-(4-ethylphenyl)-4-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide

CN=[C-]c1cc(C)c(C)cc1C.[CH3-].[Y]

carbanide;N-methyl-1-(2,4,5-trimethylphenyl)methanimine;yttrium

COc1cccc(NC(=O)C(=O)NCc2ccccc2)c1

N-benzyl-N'-(3-methoxyphenyl)oxamide

CC(=O)NCC=Cc1nn(C)cc1Cl

N-[3-(4-chloro-1-methylpyrazol-3-yl)prop-2-enyl]acetamide

C[C@](O)(c1ccc(S(=O)(=O)c2ccc(C#N)cc2CC2CC2)cc1)C(F)(F)F

3-(cyclopropylmethyl)-4-[4-[(2S)-1,1,1-trifluoro-2-hydroxypropan-2-yl]phenyl]sulfonylbenzonitrile

CNC(=O)C(C)NS(=O)(=O)c1cc(C)cc(N)c1C

2-[(3-amino-2,5-dimethylphenyl)sulfonylamino]-N-methylpropanamide

Nc1cc(NS(=O)(=O)CCS(=O)(=O)O)ccc1O

2-[(3-amino-4-hydroxyphenyl)sulfamoyl]ethanesulfonic acid

CC(=O)N(C)c1ccccc1NC(=O)CCC(=O)C(C)C

N-[2-[acetyl(methyl)amino]phenyl]-5-methyl-4-oxohexanamide

CC(C)CCN(C)C(=O)C(N)CC(=O)O

3-amino-4-[methyl(3-methylbutyl)amino]-4-oxobutanoic acid

CO/N=C/c1ccc(-c2noc(C(F)(F)Cl)n2)cc1

(E)-1-[4-[5-[chloro(difluoro)methyl]-1,2,4-oxadiazol-3-yl]phenyl]-N-methoxymethanimine

OCC(CO)CC1=C(c2cnn(C(F)F)c2)CN=C(c2nccs2)N1

2-[[5-[1-(difluoromethyl)pyrazol-4-yl]-2-(1,3-thiazol-2-yl)-1,4-dihydropyrimidin-6-yl]methyl]propane-1,3-diol

CC1C(C(=O)O)CCN1c1ccc(C#N)cn1

1-(5-cyanopyridin-2-yl)-2-methylpyrrolidine-3-carboxylic acid

Cl.O=S(=O)(c1cccs1)N1CCC2(CC1)NCCN=C2NCc1ccc(F)c(Cl)c1

N-[(3-chloro-4-fluorophenyl)methyl]-9-thiophen-2-ylsulfonyl-1,4,9-triazaspiro[5.5]undec-4-en-5-amine;hydrochloride

CC1(C)c2cc(N(c3ccc(-c4ccc5ccccc5c4-c4ccccc4)cc3)c3ccc(C45CC6CC(CC(C6)C4)C5)cc3)ccc2-c2c(C3CCCCC3)cccc21

N-[4-(1-adamantyl)phenyl]-5-cyclohexyl-9,9-dimethyl-N-[4-(1-phenylnaphthalen-2-yl)phenyl]fluoren-2-amine

CN(C)Cc1ccc(C(=O)Nc2nn[nH]n2)cc1

4-[(dimethylamino)methyl]-N-(2H-tetrazol-5-yl)benzamide

CC(CC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O)c1ccccc1

N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-phenylbutanamide

CC(C)(O)C#Cc1ccc2c(c1)-n1nnnc1[C@@H](NC(=O)c1n[nH]c(Cc3ccccc3)n1)CO2

5-benzyl-N-[(4R)-9-(3-hydroxy-3-methylbut-1-ynyl)-4,5-dihydrotetrazolo[5,1-d][1,5]benzoxazepin-4-yl]-1H-1,2,4-triazole-3-carboxamide

Cn1cccc1C1CC(C(=O)N2CCCCC2c2ccc(F)cc2)NN1

[2-(4-fluorophenyl)piperidin-1-yl]-[5-(1-methylpyrrol-2-yl)pyrazolidin-3-yl]methanone

CCOC(=O)C1=C(C)N=C2C[C@H](c3cccc(OC)c3)[C@H](C(=O)OCC)C(=O)C2[C@@H]1c1cc(C)sc1C

diethyl (4S,6S,7S)-4-(2,5-dimethylthiophen-3-yl)-7-(3-methoxyphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3,6-dicarboxylate

CC1CCC(F)(c2cscn2)CN1

4-(3-fluoro-6-methylpiperidin-3-yl)-1,3-thiazole

CCOC(=O)c1ccc2c(C(=Nc3ccc(N(CCN(C)C)C(=O)Cc4ccccc4)cc3)c3ccccc3)c(O)[nH]c2c1

ethyl 3-[N-[4-[2-(dimethylamino)ethyl-(2-phenylacetyl)amino]phenyl]-C-phenylcarbonimidoyl]-2-hydroxy-1H-indole-6-carboxylate

C[C@H]1CN([C@@H](C)CO)S(=O)(=O)c2ccc(C#Cc3ccccc3)cc2O[C@@H]1CN(C)C(=O)CN(C)C

2-(dimethylamino)-N-[[(4S,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-phenylethynyl)-4,5-dihydro-3H-6,1λ6,2-benzoxathiazocin-5-yl]methyl]-N-methylacetamide

NC(=O)NCCCC[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O

(2S)-6-(carbamoylamino)-2-(2,4-dinitroanilino)hexanoic acid

Cc1cc(OCC2CCCCN2C)c(CO)cn1

[6-methyl-4-[(1-methylpiperidin-2-yl)methoxy]pyridin-3-yl]methanol

CCCCCCCCCCCCCCCC(=O)NCCBr

N-(2-bromoethyl)hexadecanamide

CCOc1cc(/C=C2/NC(=O)N(CC(=O)Nc3cccc(C)c3)C2=O)cc(Br)c1OCc1ccc(I)cc1

2-[(4E)-4-[[3-bromo-5-ethoxy-4-[(4-iodophenyl)methoxy]phenyl]methylidene]-2,5-dioxoimidazolidin-1-yl]-N-(3-methylphenyl)acetamide

CN1CCN(c2ncc(CN3CCc4[nH]c(=S)[nH]c(=O)c4C3)s2)CC1

6-[[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]methyl]-2-sulfanylidene-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one

COC[C@H]1CCCN(C(=O)Cc2c(Cl)cccc2OC)C1

2-(2-chloro-6-methoxyphenyl)-1-[(3S)-3-(methoxymethyl)piperidin-1-yl]ethanone

O=C(Nc1nccs1)C(CC1CCCC1)c1ccc(S(=O)(=O)N2C=C3C=CC=CC3N2)cc1

2-[4-(1,7a-dihydroindazol-2-ylsulfonyl)phenyl]-3-cyclopentyl-N-(1,3-thiazol-2-yl)propanamide

CCC(=O)N1CCC(C2OCCO2)CC1

1-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-one

CCNC(=NCC1CC(=O)Nc2ccccc21)NCCn1ccnc1

1-ethyl-3-(2-imidazol-1-ylethyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-4-yl)methyl]guanidine

CCN1C=CC(/C=C/c2ccccc2N(C)CCSS)=CC1

N-[2-(disulfanyl)ethyl]-2-[(E)-2-(1-ethyl-2H-pyridin-4-yl)ethenyl]-N-methylaniline

COCOc1cc2c(c(OCOC)c1)C(=O)O[C@@H](C)CCCC(=O)[C@H]1OC(C)(C)O[C@H]1C/C=C/2

(2E,5S,9S,14S)-18,20-bis(methoxymethoxy)-7,7,14-trimethyl-6,8,15-trioxatricyclo[15.4.0.05,9]henicosa-1(17),2,18,20-tetraene-10,16-dione

CN(C)C(=O)c1cccc([N-]C2=C(N[C@@H](c3ccc(F)cc3)C3CC3)C(O)C2=O)c1O.[Li+]

lithium;[2-[[(R)-cyclopropyl-(4-fluorophenyl)methyl]amino]-3-hydroxy-4-oxocyclobuten-1-yl]-[3-(dimethylcarbamoyl)-2-hydroxyphenyl]azanide

CCOC(=O)c1c(NC(=O)COC(=O)[C@H]2CCCO2)sc(C(=O)NC)c1C

[2-[[3-ethoxycarbonyl-4-methyl-5-(methylcarbamoyl)thiophen-2-yl]amino]-2-oxoethyl] (2R)-oxolane-2-carboxylate

CCNC(=NCc1ccc(COCC(F)(F)F)cc1)NCCNC(=O)c1ccccc1

N-[2-[[N-ethyl-N'-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]carbamimidoyl]amino]ethyl]benzamide

O=C(O)NCCCC[C@H](NS(=O)(=O)c1cccs1)C(=O)N(CCc1cccs1)CCc1cccs1

[(5S)-6-[bis(2-thiophen-2-ylethyl)amino]-6-oxo-5-(thiophen-2-ylsulfonylamino)hexyl]carbamic acid

CC(CCc1ccccc1)NS(=O)(=O)c1ccc(F)cc1F

2,4-difluoro-N-(4-phenylbutan-2-yl)benzenesulfonamide

C1COCCOCCOCCOCCOCCO1.C=C.N.O=S(=O)([O-])C(F)(F)F.Oc1cccc(Cl)n1.Oc1cccc(Cl)n1.Oc1cccc(Cl)n1.Oc1cccc(Cl)n1.[Ru+].[Ru]

azane;6-chloropyridin-2-ol;ethene;1,4,7,10,13,16-hexaoxacyclooctadecane;ruthenium;ruthenium(1+);trifluoromethanesulfonate

CN(C)c1ccc(C=NNC(=O)C(=Cc2cccs2)NC(=O)c2ccccc2)cc1

N-[3-[2-[[4-(dimethylamino)phenyl]methylidene]hydrazinyl]-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide

COc1ccc(S(=O)(=O)N2C(=O)C[C@H](c3ccccc3)[C@@H]2c2cccc(OC)c2)cc1

(4R,5R)-5-(3-methoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-4-phenylpyrrolidin-2-one