SMILES
stringlengths 2
959
| IUPAC
stringlengths 6
1.64k
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|---|---|
COc1ccc(Cn2cc3nc(-c4cccs4)nc(Cl)c3n2)cc1.c1csc(-c2nc(Nc3ccc(CN4CCOCC4)cc3)c3[nH]ncc3n2)c1
|
7-chloro-2-[(4-methoxyphenyl)methyl]-5-thiophen-2-ylpyrazolo[4,3-d]pyrimidine;N-[4-(morpholin-4-ylmethyl)phenyl]-5-thiophen-2-yl-1H-pyrazolo[4,3-d]pyrimidin-7-amine
|
c1ccc2cc(N(c3ccc(-c4ccc(N(c5ccc(C6COC6)cc5)c5cccc6ccccc56)cc4)cc3)c3ccc(C4COC4)cc3)ccc2c1
|
N-[4-[4-[N-naphthalen-1-yl-4-(oxetan-3-yl)anilino]phenyl]phenyl]-N-[4-(oxetan-3-yl)phenyl]naphthalen-2-amine
|
O=C(NCCn1nc(-c2ccccc2)ccc1=O)C1CC2CCN1CC2
|
N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]-1-azabicyclo[2.2.2]octane-2-carboxamide
|
N/C(=N/O)c1ccc(N2CCC(C(=O)O)CC2)cc1
|
1-[4-[(E)-N'-hydroxycarbamimidoyl]phenyl]piperidine-4-carboxylic acid
|
C=C1[C@@H]2CC[C@H]3[C@]4(C)C[C@H](O[C@@H]5O[C@H](COC(=O)CCC(=O)NCCc6cc(I)c(O)c(I)c6)[C@@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]5OC(=O)CC(C)C)C[C@@H](C(=O)O)[C@H]4CC[C@]3(C2)[C@@H]1O
|
(1R,4R,5R,7R,9R,10S,13R,15R)-15-hydroxy-7-[(2R,3R,4R,5R,6R)-6-[[4-[2-(4-hydroxy-3,5-diiodophenyl)ethylamino]-4-oxobutanoyl]oxymethyl]-3-(3-methylbutanoyloxy)-4,5-disulfooxyoxan-2-yl]oxy-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
|
CCOC(=O)C(=O)N(CCCO)C1CCC1
|
ethyl 2-[cyclobutyl(3-hydroxypropyl)amino]-2-oxoacetate
|
C=CC(=O)Nc1cnc(OCCOCC)cn1
|
N-[5-(2-ethoxyethoxy)pyrazin-2-yl]prop-2-enamide
|
CCCNCC1CCN(S(=O)(=O)NC2CCCCC2)CC1
|
N-cyclohexyl-4-(propylaminomethyl)piperidine-1-sulfonamide
|
O=S(=O)([O-])COc1ccccc1O.O=S(=O)([O-])COc1ccccc1O.[Ca+2]
|
calcium;(2-hydroxyphenoxy)methanesulfonate
|
CCCCC/C=C\C[C@@H](O)/C=C/C=C\C/C=C\CCCC(=O)OC[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@H](O)[C@@H]1O)OC(=O)CCCCCCCCCCC(C)C
|
[(2R)-3-[[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-(12-methyltridecanoyloxy)propyl] (5Z,8Z,10E,12R,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoate
|
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)cc1
|
(2S)-2-[(4-methoxyphenyl)sulfonylamino]-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanamide
|
O=S(=O)(c1cccs1)N1CCN(c2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2)[C@@H](CC2CCOCC2)C1
|
1,1,1,3,3,3-hexafluoro-2-[4-[(2S)-2-(oxan-4-ylmethyl)-4-thiophen-2-ylsulfonylpiperazin-1-yl]phenyl]propan-2-ol
|
CC(C)C(C)(C)CNC(=O)[C@@H](N)Cc1ccc(O)c(O)c1
|
(2S)-2-amino-3-(3,4-dihydroxyphenyl)-N-(2,2,3-trimethylbutyl)propanamide
|
CCCCCCCCCCCCCCCCOc1ccc(C(=O)O)cc1S(=O)(=O)N/N=c1\sc(-c2cccc(S(=O)(=O)O)c2)nn1C
|
4-hexadecoxy-3-[[(Z)-[3-methyl-5-(3-sulfophenyl)-1,3,4-thiadiazol-2-ylidene]amino]sulfamoyl]benzoic acid
|
COc1cccc(NC(=O)CC(=O)N/N=C/c2ccc(O)c(Br)c2)c1
|
N'-[(E)-(3-bromo-4-hydroxyphenyl)methylideneamino]-N-(3-methoxyphenyl)propanediamide
|
COc1cccc(N2C(=S)NC(c3ccccn3)C2c2ccco2)c1
|
5-(furan-2-yl)-1-(3-methoxyphenyl)-4-pyridin-2-ylimidazolidine-2-thione
|
COC(=O)c1sccc1S(=O)(=O)NCC1CCN(c2ccccn2)CC1
|
methyl 3-[(1-pyridin-2-ylpiperidin-4-yl)methylsulfamoyl]thiophene-2-carboxylate
|
O=C(CN1CCN(C(=O)c2c(F)cccc2F)CC1)NCCc1cccc2cccnc12
|
2-[4-(2,6-difluorobenzoyl)piperazin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide
|
CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCCCC/C=C\CCCCCCCCCC
|
[3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-2-[(9Z,12Z,15Z,18Z,21Z)-tetracosa-9,12,15,18,21-pentaenoyl]oxypropyl] (Z)-octacos-17-enoate
|
CC(C)(C)OC(=O)N1CCC(CC(=O)O)CC1F
|
2-[2-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid
|
COc1cccc(C2=NN(C(=O)c3ccccc3Cl)[C@H](c3cc4cccc(OC)c4nc3Cl)C2)c1
|
[(3S)-3-(2-chloro-8-methoxyquinolin-3-yl)-5-(3-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-(2-chlorophenyl)methanone
|
Cn1c(OC2CCCCC2)nc2c(F)cc(OC3COC3)c(F)c21
|
2-cyclohexyloxy-4,7-difluoro-1-methyl-6-(oxetan-3-yloxy)benzimidazole
|
Cc1cc(C(=O)CSc2nn3c(=O)c(C(C)(C)C)nnc3s2)c(C)n1CCC1=CCCCC1
|
3-tert-butyl-7-[2-[1-[2-(cyclohexen-1-yl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
|
CCn1nc(C)c(Cl)c1CNc1cccc(CCl)c1
|
N-[(4-chloro-2-ethyl-5-methylpyrazol-3-yl)methyl]-3-(chloromethyl)aniline
|
O=c1ccnc2sc(NCC[S@@](=O)Cc3ccccc3)nn12
|
2-[2-[(S)-benzylsulfinyl]ethylamino]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
|
CCN(CC)CCn1c(Cc2ccccc2)nc2cc(Cl)ccc21
|
2-(2-benzyl-5-chlorobenzimidazol-1-yl)-N,N-diethylethanamine
|
CCn1c(-c2cnc3c(c2)CCN3C)nc2cc(C(=O)O)cnc21
|
3-ethyl-2-(1-methyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-yl)imidazo[4,5-b]pyridine-6-carboxylic acid
|
O=C(COc1ccc(Cl)cc1)NCCO
|
2-(4-chlorophenoxy)-N-(2-hydroxyethyl)acetamide
|
CCC(CC)N(CC)Cc1nc(Cc2ccccc2)no1
|
N-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl]-N-ethylpentan-3-amine
|
COc1cccc(NC(=O)NC2COCCN2CC2=NCC(=O)N(CC(=O)N(C)c3ccccc3)c3ccccc32)c1
|
2-[5-[[3-[(3-methoxyphenyl)carbamoylamino]morpholin-4-yl]methyl]-2-oxo-3H-1,4-benzodiazepin-1-yl]-N-methyl-N-phenylacetamide
|
CC(=O)C[C@@H](C)c1ccc(OC2CN(c3nccc(C(F)(F)F)n3)C2)cc1
|
(4R)-4-[4-[1-[4-(trifluoromethyl)pyrimidin-2-yl]azetidin-3-yl]oxyphenyl]pentan-2-one
|
CCN(C(=O)COC1CCOCC1)c1cccnc1
|
N-ethyl-2-(oxan-4-yloxy)-N-pyridin-3-ylacetamide
|
COc1ccc(CC(=O)Nc2c(C(=O)N3CCOCC3)sc3nc(C)cc(C)c23)cc1F
|
N-[4,6-dimethyl-2-(morpholine-4-carbonyl)thieno[2,3-b]pyridin-3-yl]-2-(3-fluoro-4-methoxyphenyl)acetamide
|
COc1ccc2c(c1)CCc1cc(OC)ccc1C2CCO
|
2-(6,13-dimethoxy-2-tricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaenyl)ethanol
|
CCc1ccc(OCC#Cc2ccc(CC[C@@H](C)C(N)OC(=O)C=CC(=O)O)s2)cc1
|
4-[(2R)-1-amino-4-[5-[3-(4-ethylphenoxy)prop-1-ynyl]thiophen-2-yl]-2-methylbutoxy]-4-oxobut-2-enoic acid
|
Cc1ccc(-c2noc(COC(=O)C3CCCN(S(=O)(=O)c4ccc(Cl)cc4)C3)n2)cc1F
|
[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate
|
COc1ccccc1NC(=S)N(CCN(C)C)[C@H](C)c1ccccn1
|
1-[2-(dimethylamino)ethyl]-3-(2-methoxyphenyl)-1-[(1R)-1-pyridin-2-ylethyl]thiourea
|
CCCC(C1CC1)n1cc(-c2cc(F)c(OC)cc2C)nc1CC
|
1-(1-cyclopropylbutyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)imidazole
|
Cc1nn(-c2ccc(Cl)cc2N)c(C)c1Br
|
2-(4-bromo-3,5-dimethylpyrazol-1-yl)-5-chloroaniline
|
CCn1cnnc1CC(C)(C)CC(=O)O
|
4-(4-ethyl-1,2,4-triazol-3-yl)-3,3-dimethylbutanoic acid
|
C=C(OCC)c1ccc(-c2ccc(C(C)C)c(-n3ccc(C)n3)c2)cc1
|
1-[5-[4-(1-ethoxyethenyl)phenyl]-2-propan-2-ylphenyl]-3-methylpyrazole
|
CCC(CC)(CO)NCC=Cc1ccccc1OC
|
2-ethyl-2-[3-(2-methoxyphenyl)prop-2-enylamino]butan-1-ol
|
CC(C)(C)OC(=O)N1CCC(NC(=O)CO)CC1
|
tert-butyl 4-[(2-hydroxyacetyl)amino]piperidine-1-carboxylate
|
O=C(O)c1c(OCc2ccco2)cccc1[N+](=O)[O-]
|
2-(furan-2-ylmethoxy)-6-nitrobenzoic acid
|
O=C(NC12CCCC(C#Cc3cccc(F)n3)(CC1)C2)c1cnccn1
|
N-[5-[2-(6-fluoropyridin-2-yl)ethynyl]-1-bicyclo[3.2.1]octanyl]pyrazine-2-carboxamide
|
CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O
|
(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-N-[(2S)-1-amino-3-naphthalen-2-yl-1-oxopropan-2-yl]-5-(diaminomethylideneamino)pentanamide
|
CC1(CNC(=O)c2cccs2)CCCS1
|
N-[(2-methylthiolan-2-yl)methyl]thiophene-2-carboxamide
|
O=C(CN1CCNCC1)Nc1c(Cl)cc([N+](=O)[O-])cc1Cl
|
N-(2,6-dichloro-4-nitrophenyl)-2-piperazin-1-ylacetamide
|
CSC1CCCCN(S(N)(=O)=O)C1
|
3-methylsulfanylazepane-1-sulfonamide
|
CCN(CCNC(=NC)NCc1cccc(C)n1)c1cccc(C)c1.I
|
1-[2-(N-ethyl-3-methylanilino)ethyl]-2-methyl-3-[(6-methylpyridin-2-yl)methyl]guanidine;hydroiodide
|
CC(=O)N[C@@H]1[C@H](O[C@@H]2[C@@H](O[C@@H]3[C@H](O)[C@H](O[C@H]4[C@H](O)[C@@H](NC(C)=O)[C@H](O[C@H]5[C@H](O)[C@@H](NC(C)=O)[C@H](O)O[C@@H]5CO)O[C@@H]4CO)O[C@H](CO[C@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5NC(C)=O)[C@@H](O)[C@H](O)[C@@H]4O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@H]3O)O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O
|
N-[(2R,3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[(2S,3S,4S,5R,6R)-4-[(2R,3S,4S,5S,6R)-5-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3S,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
|
CCN(CC1CCCN(CCc2cccc(Cl)c2)C1)C(=O)c1cc2ccccc2[nH]1
|
N-[[1-[2-(3-chlorophenyl)ethyl]piperidin-3-yl]methyl]-N-ethyl-1H-indole-2-carboxamide
|
CC(C)C[C@H](NC(=O)CC(NC(=O)[C@@H](N)Cc1cnc[nH]1)c1cccc(NC(=O)[C@@H](N)C(C)C)c1)C(=O)O
|
(2S)-2-[[3-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-[3-[[(2S)-2-amino-3-methylbutanoyl]amino]phenyl]propanoyl]amino]-4-methylpentanoic acid
|
COc1ccc(C(=O)Oc2ccc(/C(C)=N/NC(=O)Cn3nc(C)c([N+](=O)[O-])c3C)cc2OC)cc1
|
[4-[(E)-N-[[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]amino]-C-methylcarbonimidoyl]-2-methoxyphenyl] 4-methoxybenzoate
|
[2H][C@@H](O)CCCCCCC
|
(1R)-1-deuteriooctan-1-ol
|
CC[C@@H](C)NC(=O)[C@H](C)N(Cc1cccc(Cl)c1)C(=O)CSCc1ccccc1C
|
(2S)-N-[(2R)-butan-2-yl]-2-[(3-chlorophenyl)methyl-[2-[(2-methylphenyl)methylsulfanyl]acetyl]amino]propanamide
|
Cn1c(=O)c(-n2cc(-c3ccccc3)nn2)cc2ccccc21
|
1-methyl-3-(4-phenyltriazol-1-yl)quinolin-2-one
|
COC(=O)C(CC1CC(C)(C)C1)NC(=O)OC(C)(C)C
|
methyl 3-(3,3-dimethylcyclobutyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
|
CCOC(=O)c1cc(NC(=O)C2(c3ccc(Cl)cc3Cl)CCCCC2)ccc1OC
|
ethyl 5-[[1-(2,4-dichlorophenyl)cyclohexanecarbonyl]amino]-2-methoxybenzoate
|
CCCCCCC(Cl)Cl.CCOC(=O)CCO
|
1,1-dichloroheptane;ethyl 3-hydroxypropanoate
|
CCCCOCC(O)CSc1n[nH]c(=O)n1CCC
|
3-(3-butoxy-2-hydroxypropyl)sulfanyl-4-propyl-1H-1,2,4-triazol-5-one
|
CC(C)c1nc(NC(C)C2CCCC2)cc(=O)[nH]1
|
4-(1-cyclopentylethylamino)-2-propan-2-yl-1H-pyrimidin-6-one
|
CCSC1CCCCN(c2nc3ccccn3c(=O)c2[N+](=O)[O-])C1
|
2-(3-ethylsulfanylazepan-1-yl)-3-nitropyrido[1,2-a]pyrimidin-4-one
|
O=C(NC1CCN(CC2CCCC2)CC1)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1
|
3-[(3-chlorophenyl)sulfamoyl]-N-[1-(cyclopentylmethyl)piperidin-4-yl]benzamide
|
Cc1cccc(CN2CCC(NC(=O)c3cc4ccc(C)cc4nc3C)CC2)c1
|
2,7-dimethyl-N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]quinoline-3-carboxamide
|
COc1ccc(N(C)S(C)(=O)=O)cc1C(=O)NC(c1ccccc1)c1ccccc1
|
N-benzhydryl-2-methoxy-5-[methyl(methylsulfonyl)amino]benzamide
|
CCCCCCN(C(=O)C(CCC(N)=O)NC(=O)OC(C)(C)C)C(C(=O)NC(Cc1ccccc1)C(=O)OC(C)(C)C)c1ccccc1O
|
tert-butyl 2-[[2-[[5-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoyl]-hexylamino]-2-(2-hydroxyphenyl)acetyl]amino]-3-phenylpropanoate
|
CCOC(=O)c1cccc(OC[C@@H](O)Cn2cnc3sccc3c2=O)c1
|
ethyl 3-[(2S)-2-hydroxy-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propoxy]benzoate
|
Cc1ccc2c(c1C)NC(=O)[C@@]21N[C@@H]([C@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21
|
(1R,3S,3aR,6aS)-5-(1,3-benzodioxol-5-ylmethyl)-1-[(1S)-1-hydroxyethyl]-6',7'-dimethylspiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-1H-indole]-2',4,6-trione
|
COc1cc(C=CCCc2ccccc2)cc(O)c1CC=C(C)C
|
3-methoxy-2-(3-methylbut-2-enyl)-5-(4-phenylbut-1-enyl)phenol
|
COc1cc(/C=N\NC(=S)Nc2ccccc2)c(Br)cc1OCC#N
|
1-[(Z)-[2-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methylideneamino]-3-phenylthiourea
|
CC(C)(C)C(=N)c1ccc(I)cc1
|
1-(4-iodophenyl)-2,2-dimethylpropan-1-imine
|
CC(C)CCN(C)C(=O)Nc1ccc(C(=O)O)cc1Cl
|
3-chloro-4-[[methyl(3-methylbutyl)carbamoyl]amino]benzoic acid
|
COc1ncnc(OC)c1C(=O)N1CCC[C@@H]1CC(=O)O
|
2-[(2R)-1-(4,6-dimethoxypyrimidine-5-carbonyl)pyrrolidin-2-yl]acetic acid
|
BrC(CCCCCCCCCCC(Br)[N+]12CCC(CC1)CC2)[N+]12CCC(CC1)CC2
|
1-[12-(1-azoniabicyclo[2.2.2]octan-1-yl)-1,12-dibromododecyl]-1-azoniabicyclo[2.2.2]octane
|
CN=C(NCc1cccc(CN2CCOCC2)c1)NCc1coc(-c2ccc(C)cc2)n1
|
2-methyl-1-[[2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]-3-[[3-(morpholin-4-ylmethyl)phenyl]methyl]guanidine
|
COc1ccc(C(=O)NC(CNC(=O)C2CCN(C3CCN(C)CC3)CC2)c2ccccc2)cc1
|
N-[2-[(4-methoxybenzoyl)amino]-2-phenylethyl]-1-(1-methylpiperidin-4-yl)piperidine-4-carboxamide
|
CCNC(=O)NC(=O)C(C)OC(=O)c1ccc(S(C)(=O)=O)cc1
|
[1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 4-methylsulfonylbenzoate
|
O=C(O)CC1CCCCN1C(=O)NC1C=CS(=O)(=O)C1
|
2-[1-[(1,1-dioxo-2,3-dihydrothiophen-3-yl)carbamoyl]piperidin-2-yl]acetic acid
|
COC(=O)[C@H](C)Oc1ccc(Br)cc1C=Nn1c(C2CCCCC2)nc2ccc(Br)cc2c1=O
|
methyl (2S)-2-[4-bromo-2-[(6-bromo-2-cyclohexyl-4-oxoquinazolin-3-yl)iminomethyl]phenoxy]propanoate
|
COC(=O)c1cc(C)nc(N2CCN(C3CCCCC3)CC2)n1
|
methyl 2-(4-cyclohexylpiperazin-1-yl)-6-methylpyrimidine-4-carboxylate
|
CCCCCCCCC=CCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCC=CCCCCCCCC
|
(3-hydroxy-2-tetracos-15-enoyloxypropyl) tetracos-15-enoate
|
C[C@H](CCCO)N[C@@H]1CCSC1
|
(4R)-4-[[(3R)-thiolan-3-yl]amino]pentan-1-ol
|
O=C(Nc1cc(Cl)ccc1N1CCOCC1)N[C@@H](c1ccccc1)c1ccccn1
|
1-(5-chloro-2-morpholin-4-ylphenyl)-3-[(S)-phenyl(pyridin-2-yl)methyl]urea
|
N#Cc1cccc2c1C1c3ccccc3C23c2c(ccc(-c4cccc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c2C#N)C13
|
4-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]hexacyclo[7.6.6.01,8.02,7.010,15.016,21]henicosa-2(7),3,5,10,12,14,16,18,20-nonaene-3,11-dicarbonitrile
|
CCN1CCN(c2nc(-c3ccc(Oc4ccc(F)cc4)cc3)c3ccccc3n2)CC1.CN(N)c1nc(-c2ccc(Oc3ccc(F)cc3)cc2)c2ccccc2n1.OC1CCN(c2nc(-c3ccc(Oc4ccc(F)cc4)cc3)c3ccccc3n2)CC1
|
2-(4-ethylpiperazin-1-yl)-4-[4-(4-fluorophenoxy)phenyl]quinazoline;1-[4-[4-(4-fluorophenoxy)phenyl]quinazolin-2-yl]-1-methylhydrazine;1-[4-[4-(4-fluorophenoxy)phenyl]quinazolin-2-yl]piperidin-4-ol
|
CNc1nc(Nc2cn(CC(F)(F)F)nc2C)ncc1Cl
|
5-chloro-4-N-methyl-2-N-[3-methyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]pyrimidine-2,4-diamine
|
CCCN(c1ccccc1)S(=O)(=O)CCl
|
1-chloro-N-phenyl-N-propylmethanesulfonamide
|
CC(=O)c1ccc(N2CCN(Cc3ccccc3)C2=O)cc1Cl
|
1-(4-acetyl-3-chlorophenyl)-3-benzylimidazolidin-2-one
|
NCCCCCNc1cccc(C(=O)NC2CCCCC2)c1
|
3-(5-aminopentylamino)-N-cyclohexylbenzamide
|
N[C@@H](CC(=O)N1CCC[C@H]1CNS(=O)(=O)c1ccccc1)CN1CC(F)(F)CCC1O
|
N-[[(2S)-1-[(3S)-3-amino-4-(5,5-difluoro-2-hydroxypiperidin-1-yl)butanoyl]pyrrolidin-2-yl]methyl]benzenesulfonamide
|
CSCCC(C)N(C)c1nc2sccn2c1CO
|
[6-[methyl(4-methylsulfanylbutan-2-yl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
|
CN=C(NCCS(C)(=O)=O)N1CCN(C(C)C(=O)N2CCCC2)CC1.I
|
N'-methyl-N-(2-methylsulfonylethyl)-4-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)piperazine-1-carboximidamide;hydroiodide
|
CC#CC#CC#CC#CC#CC#CC#CC(=O)OC[C@H](CO)OC(=O)CCCCCCCCCCCC.CC(N)=O.[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH]
|
acetamide;[(2S)-3-hydroxy-2-tridecanoyloxypropyl] hexadeca-2,4,6,8,10,12,14-heptaynoate;molecular hydrogen
|
C=C(C)C1=CC=C(F)CC1
|
1-fluoro-4-prop-1-en-2-ylcyclohexa-1,3-diene
|
Cc1cc(OCc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)c(C(=O)c2ccccc2)c(C)n1
|
[2,6-dimethyl-4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methoxy]pyridin-3-yl]-phenylmethanone
|
COCCOc1cccc(C(=O)Nc2ccc3c(ccn3CC(C)C)c2)c1
|
3-(2-methoxyethoxy)-N-[1-(2-methylpropyl)indol-5-yl]benzamide
|
CNc1cccc(C(=O)NCC2(C)CCCS2)n1
|
6-(methylamino)-N-[(2-methylthiolan-2-yl)methyl]pyridine-2-carboxamide
|
Cc1ccc(-c2csc(-c3ccno3)n2)c(C)c1
|
5-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-1,2-oxazole
|
CN=C(NCCc1cccc(C(=O)NC)c1)NCc1csc(-c2ccccc2)n1
|
N-methyl-3-[2-[[N'-methyl-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]carbamimidoyl]amino]ethyl]benzamide
|
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