SMILES
stringlengths 2
803
| IUPAC
stringlengths 4
1.45k
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Cc1cc(C)nc(C2CCN(Cc3nc4ccc(F)cc4o3)CC2)n1
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2-[[4-(4,6-dimethylpyrimidin-2-yl)piperidin-1-yl]methyl]-6-fluoro-1,3-benzoxazole
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CC(C)Cc1ccc(/C(=C/N)SN)cc1
|
S-[(Z)-2-amino-1-[4-(2-methylpropyl)phenyl]ethenyl]thiohydroxylamine
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CCOc1ccc2nc(-c3cccc(OCC(=O)NC4CC(F)(F)C4)c3)nc(Nc3ccc(/C(C=N)=C/N)cc3)c2c1
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2-[3-[4-[4-[(Z)-1-amino-3-iminoprop-1-en-2-yl]anilino]-6-ethoxyquinazolin-2-yl]phenoxy]-N-(3,3-difluorocyclobutyl)acetamide
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Br.Cc1ccccc1N1CCN(CC2CC2c2ccccc2)CC1
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1-(2-methylphenyl)-4-[(2-phenylcyclopropyl)methyl]piperazine;hydrobromide
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CC(C)CN1CC(CN)COC1=O
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5-(aminomethyl)-3-(2-methylpropyl)-1,3-oxazinan-2-one
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CC(C)c1cnc(C(C)(C)C)c(F)n1
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2-tert-butyl-3-fluoro-5-propan-2-ylpyrazine
|
CCC1CCCC1N[C@H](C)c1cccc(F)c1
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2-ethyl-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine
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CC(CCCC/C=C/C(=O)O)c1ccc2ccccc2c1
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(E)-8-naphthalen-2-ylnon-2-enoic acid
|
CC1CCCC(O)(C2(C#N)CC3CCC2C3)C1C
|
2-(1-hydroxy-2,3-dimethylcyclohexyl)bicyclo[2.2.1]heptane-2-carbonitrile
|
Cc1cc(=O)oc2cc(OC(C)C(=O)N(Cc3nccn3C)C(C)C)c(Cl)cc12
|
2-(6-chloro-4-methyl-2-oxochromen-7-yl)oxy-N-[(1-methylimidazol-2-yl)methyl]-N-propan-2-ylpropanamide
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CCOc1cc(N)cc(C(=O)N2CCCCCC2C)c1
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(3-amino-5-ethoxyphenyl)-(2-methylazepan-1-yl)methanone
|
CC(C)[C@H]([NH-])COC(=O)[C@@H]1CCCC1P.[Ac]
|
actinium;[(2S)-3-methyl-1-[(1S)-2-phosphanylcyclopentanecarbonyl]oxybutan-2-yl]azanide
|
CO[C@H](c1ccccn1)c1ccccc1P(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
|
bis[3,5-bis(trifluoromethyl)phenyl]-[2-[(S)-methoxy(pyridin-2-yl)methyl]phenyl]phosphane
|
Cn1c(=O)c2ccccc2n2c(CN(Cc3ccccc3)Cc3ccccc3)nnc12
|
1-[(dibenzylamino)methyl]-4-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one
|
O=C(O)CCCN1C(=O)C2C3CC(C2C1=O)C1C3Sc2[nH]c(=O)sc2[C@@H]1c1cccc(OCC(=O)Nc2ccc3ccccc3c2)c1
|
4-[(9S)-9-[3-[2-(naphthalen-2-ylamino)-2-oxoethoxy]phenyl]-6,13,15-trioxo-3,7-dithia-5,14-diazapentacyclo[9.5.1.02,10.04,8.012,16]heptadec-4(8)-en-14-yl]butanoic acid
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CCOc1ccccc1C(=O)NC[C@H]1[C@H]2CN(C)C[C@]23CC[C@H]1O3
|
2-ethoxy-N-[[(1S,5S,6R,7R)-3-methyl-10-oxa-3-azatricyclo[5.2.1.01,5]decan-6-yl]methyl]benzamide
|
COc1ccc(-n2nc(C)c3sc(N4CCCC(C(=O)NCc5ccc(C)cc5)C4)nc32)cc1
|
1-[1-(4-methoxyphenyl)-3-methylpyrazolo[3,4-d][1,3]thiazol-5-yl]-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide
|
Cc1ccc(-c2cc(C(=O)NCC34CC(CN3Cc3ccccc3)C4)n[nH]2)o1
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N-[(2-benzyl-2-azabicyclo[2.1.1]hexan-1-yl)methyl]-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
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O=C(c1cc2ccc(F)cc2[nH]1)N1CCC(O)(C(=O)c2ccc(F)cc2F)CC1
|
(2,4-difluorophenyl)-[1-(6-fluoro-1H-indole-2-carbonyl)-4-hydroxypiperidin-4-yl]methanone
|
CCCN(C)C(=S)NCc1ccc(Cl)nc1
|
3-[(6-chloropyridin-3-yl)methyl]-1-methyl-1-propylthiourea
|
CCCC(C)(N)C(=O)N1CCCN(c2nc(CC)ns2)CC1
|
2-amino-1-[4-(3-ethyl-1,2,4-thiadiazol-5-yl)-1,4-diazepan-1-yl]-2-methylpentan-1-one
|
Cc1c(Cl)cccc1-n1c(SCC(=O)c2ccc3c(c2)NC(=O)CO3)nnc1-c1ccncc1
|
6-[2-[[4-(3-chloro-2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one
|
CCCCOCO[Si](OC)(OC)c1ccccc1
|
butoxymethoxy-dimethoxy-phenylsilane
|
CCSCCCNC1CCN(Cc2ccccc2)CC1
|
1-benzyl-N-(3-ethylsulfanylpropyl)piperidin-4-amine
|
CC(Cc1ccco1)Nc1ccc(-n2cnnn2)cc1
|
N-[1-(furan-2-yl)propan-2-yl]-4-(tetrazol-1-yl)aniline
|
O=C1CCCC2=C1[C@@H](c1ccco1)c1c(ncn3nc(-c4ccccc4)nc13)O2
|
(9S)-9-(furan-2-yl)-13-phenyl-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),11,13,16-pentaen-7-one
|
C=C(C)[C@@H]1[C@H](CC(C)(C)CC(C)C)CC(C)(C)CC1(C)C
|
(2S,3R)-1,1,5,5-tetramethyl-2-prop-1-en-2-yl-3-(2,2,4-trimethylpentyl)cyclohexane
|
CN(C1CCCCC1O)S(=O)(=O)c1ccc2c(c1)CCC2
|
N-(2-hydroxycyclohexyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide
|
COCCCOCCOCCCCNC(C)(C)C
|
N-tert-butyl-4-[2-(3-methoxypropoxy)ethoxy]butan-1-amine
|
CCC(Oc1ccc(F)cc1)C(=O)NC(C)c1ccc(F)cc1
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2-(4-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]butanamide
|
Nc1cc(C(=O)N2CC(c3nn(CC(=O)NCC(F)F)c4cccc(F)c34)C2)ccn1
|
2-[3-[1-(2-aminopyridine-4-carbonyl)azetidin-3-yl]-4-fluoroindazol-1-yl]-N-(2,2-difluoroethyl)acetamide
|
Nc1cncc(-c2ccc(C(=O)N(CCO)C3CCCCC3)cc2)c1
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4-(5-aminopyridin-3-yl)-N-cyclohexyl-N-(2-hydroxyethyl)benzamide
|
Cc1nc(SCC(=O)NC(C)CCCC(C)C)c2ccccc2n1
|
N-(6-methylheptan-2-yl)-2-(2-methylquinazolin-4-yl)sulfanylacetamide
|
S=c1nc(CSc2ccccc2Br)[nH]c2c1CCCCC2
|
2-[(2-bromophenyl)sulfanylmethyl]-1,5,6,7,8,9-hexahydrocyclohepta[d]pyrimidine-4-thione
|
CCCCN(C)CC.O=CO
|
N-ethyl-N-methylbutan-1-amine;formic acid
|
Cc1ccc(-c2ccc(C=O)o2)c([N+](=O)[O-])c1
|
5-(4-methyl-2-nitrophenyl)furan-2-carbaldehyde
|
Cc1ccc(NC(=O)N/C=C/c2ccccc2)c(C)c1
|
1-(2,4-dimethylphenyl)-3-[(E)-2-phenylethenyl]urea
|
O=S(=O)(NC1CCN(CCOc2cccc3c2OCCO3)CC1)c1cccc2ccccc12
|
N-[1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]piperidin-4-yl]naphthalene-1-sulfonamide
|
CSc1ccc(-c2nc(CC(C)N)cs2)cc1
|
1-[2-(4-methylsulfanylphenyl)-1,3-thiazol-4-yl]propan-2-amine
|
[Au+].[Au+].[C-]#Cc1ccc2c(c1)C(C)(C)c1ccccc1-2.[C-]#Cc1ccc2c(c1)C(C)(C)c1ccccc1-2.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
|
diphenylphosphaniumylmethyl(diphenyl)phosphanium;2-ethynyl-9,9-dimethylfluorene;gold(1+)
|
CC(C)c1cc(C(=O)O)n[nH]1.CC(Cc1cc(C(=O)O)n[nH]1)c1ccccc1.CC(Cc1ccccc1)c1cc(C(=O)O)n[nH]1.CC1CCc2[nH]nc(C(=O)O)c2C1.O=C(O)c1cc(CCc2ccccc2Br)c[nH]1.O=C(O)c1cc(COc2ccccc2)[nH]n1.O=C(O)c1n[nH]c2c1CCCC2.O=C(O)c1n[nH]c2c1CCCC2Cc1ccccc1.O=C(O)c1n[nH]c2c1CCCCC2.O=C(O)c1n[nH]c2c1CCCCCC2
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7-benzyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid;4-[2-(2-bromophenyl)ethyl]-1H-pyrrole-2-carboxylic acid;1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxylic acid;4,5,6,7,8,9-hexahydro-1H-cycloocta[c]pyrazole-3-carboxylic acid;5-methyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid;5-(phenoxymethyl)-1H-pyrazole-3-carboxylic acid;5-(1-phenylpropan-2-yl)-1H-pyrazole-3-carboxylic acid;5-(2-phenylpropyl)-1H-pyrazole-3-carboxylic acid;5-propan-2-yl-1H-pyrazole-3-carboxylic acid;4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
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COc1ccc(-n2c(C)cc(C(=O)NCc3ccc(/C(N)=N/C(=O)OCc4ccccc4)cc3)c2C)cc1
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benzyl (NZ)-N-[amino-[4-[[[1-(4-methoxyphenyl)-2,5-dimethylpyrrole-3-carbonyl]amino]methyl]phenyl]methylidene]carbamate
|
CC(C)(C)[Si](OC[C@H]1O[C@H]2C[C@H](COCc3ccccc3)O[C@@H]1[C@@H]2I)(c1ccccc1)c1ccccc1
|
tert-butyl-[[(1S,3R,5S,7R,8R)-8-iodo-3-(phenylmethoxymethyl)-2,6-dioxabicyclo[3.2.1]octan-7-yl]methoxy]-diphenylsilane
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Cc1ccc(C)c(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2ccccc2C(F)(F)F)N3)c1
|
(3aR,4S,9bS)-N-(2,5-dimethylphenyl)-4-[2-(trifluoromethyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide
|
CC(C)[C@H](C#N)N1CCN(C(=O)CN(C)C[C@@H]2CCC[C@@H]2O)CC1
|
(2R)-2-[4-[2-[[(1S,2S)-2-hydroxycyclopentyl]methyl-methylamino]acetyl]piperazin-1-yl]-3-methylbutanenitrile
|
CC(NC(=O)COC(=O)C(C#N)=Cc1ccc(N(C)C)cc1)c1ccc(Cl)cc1Cl
|
[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] 2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enoate
|
CC1CCCC1C(=O)N(CCCN)C1CCCCCC1
|
N-(3-aminopropyl)-N-cycloheptyl-2-methylcyclopentane-1-carboxamide
|
Cc1ncc(OCC2(c3ccccc3)C[C@H]2CO)c(C)n1
|
[(1R)-2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]-2-phenylcyclopropyl]methanol
|
COCCNCCNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O.Cl
|
2-cyclopropyl-N-[2-(2-methoxyethylamino)ethyl]-1,1,3-trioxo-1,2-benzothiazole-6-carboxamide;hydrochloride
|
N#Cc1ccc(F)c(CS(=O)(=O)c2ccc(N)cc2Br)c1
|
3-[(4-amino-2-bromophenyl)sulfonylmethyl]-4-fluorobenzonitrile
|
CC(NC(=O)COC(C)(C)C)c1ccc(F)c(F)c1
|
N-[1-(3,4-difluorophenyl)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
|
CN(C)c1nc(=O)n(C(=O)N(Cl)C(C)(C)C)n1C
|
N-tert-butyl-N-chloro-3-(dimethylamino)-2-methyl-5-oxo-1,2,4-triazole-1-carboxamide
|
CC(NC1CCCC1(C)C)c1ccc2c(c1)OCO2
|
N-[1-(1,3-benzodioxol-5-yl)ethyl]-2,2-dimethylcyclopentan-1-amine
|
COc1nc(N2CCCCCC2)nc(N2CCC3(CCCN3)CC2)n1
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8-[4-(azepan-1-yl)-6-methoxy-1,3,5-triazin-2-yl]-1,8-diazaspiro[4.5]decane
|
O=C(Nc1cccc(-c2nnc3n2CCCCC3)c1)c1csc(-c2ccsc2)n1
|
N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-thiophen-3-yl-1,3-thiazole-4-carboxamide
|
c1cc(OC2CCOCC2)c2nc(NC3CCOCC3)ncc2c1
|
N-(oxan-4-yl)-8-(oxan-4-yloxy)quinazolin-2-amine
|
CNC[C@H](CC1CCCCC1)NC(=O)c1cccc([C@@H](OCCNC(C)=O)c2ccccc2)c1
|
3-[(S)-2-acetamidoethoxy(phenyl)methyl]-N-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]benzamide
|
CC1=NN(c2ccc(F)cc2)C(=O)/C1=C\c1c(C)[nH]n(-c2ccccc2C)c1=O
|
(4Z)-2-(4-fluorophenyl)-5-methyl-4-[[5-methyl-2-(2-methylphenyl)-3-oxo-1H-pyrazol-4-yl]methylidene]pyrazol-3-one
|
COc1ccc(C(=O)NCCOC(N)=O)c(O)c1
|
2-[(2-hydroxy-4-methoxybenzoyl)amino]ethyl carbamate
|
Cc1cc(C)n(CC(C)CNC(=O)NCCc2cccs2)n1
|
1-[3-(3,5-dimethylpyrazol-1-yl)-2-methylpropyl]-3-(2-thiophen-2-ylethyl)urea
|
CCC(C)C(=O)NCC(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1
|
N-[2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-2-methylbutanamide
|
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)/C=C(/C)[C@@H](CCOC(=O)c2ccnc3ccccc23)[C@]1(C)O
|
2-[(2R,3S,4R,5Z,7R,9S,10R,11S,12S,13R)-10-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3-hydroxy-12-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-9-methoxy-3,5,7,9,11,13-hexamethyl-14-oxo-1-oxacyclotetradec-5-en-4-yl]ethyl quinoline-4-carboxylate
|
CC(C)Oc1cccc2c1c(NC(=O)C1CC(=O)N(C)C1)nn2Cc1ccccc1
|
N-(1-benzyl-4-propan-2-yloxyindazol-3-yl)-1-methyl-5-oxopyrrolidine-3-carboxamide
|
Cc1ccc(Oc2nc(C)nc(N3CCCC(C)C3)c2N)cc1
|
2-methyl-4-(4-methylphenoxy)-6-(3-methylpiperidin-1-yl)pyrimidin-5-amine
|
CCN(C(=O)c1ccc(OC)c(S(=O)(=O)N(CC)CC)c1)C1CCCCC1
|
N-cyclohexyl-3-(diethylsulfamoyl)-N-ethyl-4-methoxybenzamide
|
COc1cc(C(=O)N2CCC[C@]3(CCC(=O)N(C4CC4)C3)C2)ccn1
|
(6S)-2-cyclopropyl-8-(2-methoxypyridine-4-carbonyl)-2,8-diazaspiro[5.5]undecan-3-one
|
COc1cc(N)c(Cl)cc1C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1
|
(4-amino-5-chloro-2-methoxyphenyl)-[3,3-bis(trifluoromethyl)pyrrolidin-1-yl]methanone
|
CCOC(=O)c1ccc(N2C(=O)c3cccc4cc(Br)cc(c34)C2=O)cc1
|
ethyl 4-(5-bromo-1,3-dioxobenzo[de]isoquinolin-2-yl)benzoate
|
CCOCCCNC(=O)c1ccc([N+](=O)[O-])c(NC)c1
|
N-(3-ethoxypropyl)-3-(methylamino)-4-nitrobenzamide
|
CC(C)(C)c1ccc(C(NC2CN(C(=N)N)C2)C(F)(F)F)cc1.C[C@H](NCCCN=C(N)N)c1ccc(-n2cc3cc(C(C)(C)C)[nH]c3nc2=O)cc1
|
2-[3-[[(1S)-1-[4-(6-tert-butyl-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl)phenyl]ethyl]amino]propyl]guanidine;3-[[1-(4-tert-butylphenyl)-2,2,2-trifluoroethyl]amino]azetidine-1-carboximidamide
|
COc1ccc(C(=O)c2ccc(Br)c(Cl)c2F)nn1
|
(4-bromo-3-chloro-2-fluorophenyl)-(6-methoxypyridazin-3-yl)methanone
|
CCOC(=O)[C@H]1CCC[C@H]1NCc1ccc(OC)cc1OC
|
ethyl (1S,2R)-2-[(2,4-dimethoxyphenyl)methylamino]cyclopentane-1-carboxylate
|
CC(C)C(=O)C(C#N)=Cc1ccc(OCc2cccc(F)c2)cc1
|
2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylidene]-4-methyl-3-oxopentanenitrile
|
COCCN1CC[C@@H](CN(C)Cc2ccc(OC)cc2C)C1
|
1-[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]-N-[(4-methoxy-2-methylphenyl)methyl]-N-methylmethanamine
|
C=Cc1cnc(Nc2ccc(N3CCN(C)CC3)c(CC)c2)nc1Nc1ccc2c(c1N(C)S(=O)(=O)C(C)C)OCCO2
|
N-[6-[[5-ethenyl-2-[3-ethyl-4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]-2,3-dihydro-1,4-benzodioxin-5-yl]-N-methylpropane-2-sulfonamide
|
CC(CCc1ccco1)Nc1scnc1C(=O)O
|
5-[4-(furan-2-yl)butan-2-ylamino]-1,3-thiazole-4-carboxylic acid
|
CCc1cc(Cl)nc(NCc2ccccc2OC)n1
|
4-chloro-6-ethyl-N-[(2-methoxyphenyl)methyl]pyrimidin-2-amine
|
CC(=O)N[C@H]1CCC2C3Cc4ccc(OCc5ccccc5)c5c4C2(CCN3C)[C@H]1O5
|
N-[(7S,7aR)-3-methyl-9-phenylmethoxy-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]acetamide
|
CCOC(=O)c1ccc(COC(=O)c2cccc(N3C(=O)[C@H]4CC=CC[C@H]4C3=O)c2)cc1
|
(4-ethoxycarbonylphenyl)methyl 3-[(3aR,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]benzoate
|
N#CCBr.NC(=O)Cn1c(CO)nc2cc(OCc3ccccc3)c(Cl)cc21.Nc1cc(Cl)c(OCc2ccccc2)cc1N.Nc1cc(OCc2ccccc2)c(Cl)cc1CC(=O)CO.O=C(O)CO.OCc1nc2cc(OCc3ccccc3)c(Cl)cc2[nH]1.[C-]#[N+]Cn1c(CO)nc2cc(OCc3ccccc3)c(Cl)cc21
|
1-(2-amino-5-chloro-4-phenylmethoxyphenyl)-3-hydroxypropan-2-one;2-bromoacetonitrile;2-[6-chloro-2-(hydroxymethyl)-5-phenylmethoxybenzimidazol-1-yl]acetamide;[6-chloro-1-(isocyanomethyl)-5-phenylmethoxybenzimidazol-2-yl]methanol;4-chloro-5-phenylmethoxybenzene-1,2-diamine;(6-chloro-5-phenylmethoxy-1H-benzimidazol-2-yl)methanol;2-hydroxyacetic acid
|
CCOC(=O)CN(CC(=O)OCC)c1ccc(Cc2c3ccccc3cc3ccccc23)cc1
|
ethyl 2-[4-(anthracen-9-ylmethyl)-N-(2-ethoxy-2-oxoethyl)anilino]acetate
|
O=C(OCc1nc2ccc(Cl)cc2n1CCO)c1nn(-c2ccccc2)c(=O)c2ccccc12
|
[6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 4-oxo-3-phenylphthalazine-1-carboxylate
|
COc1ccc2[se][nH]c(=O)c2c1
|
5-methoxy-1,2-benzoselenazol-3-one
|
CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(C(F)(F)F)cc1
|
N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-4-(trifluoromethyl)benzamide
|
COc1ccc(Cn2nnnc2[C@@H](c2cc3cc(C)cc(C)c3[nH]c2=O)N2CCN(Cc3ccccc3)CC2)cc1
|
3-[(R)-(4-benzylpiperazin-1-yl)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]methyl]-6,8-dimethyl-1H-quinolin-2-one
|
CCN(C)C(=O)C(NC(=O)[C@H](C)NC)C(C)(C)C
|
N-ethyl-N,3,3-trimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanamide
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CCNC(Cc1ccc(CC)s1)C1CN(CC)CCO1
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N-ethyl-1-(4-ethylmorpholin-2-yl)-2-(5-ethylthiophen-2-yl)ethanamine
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C[C@@H]1C(=O)OC2[C@H](OC(=O)c3ccccc3)C34C5OC(=O)C3(OC3OC(=O)[C@H](OCc6ccccc6)C34C(C(C)(C)C)[C@H]5O)[C@]21O
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[(6R,9R,12R,16S,17R)-8-tert-butyl-9,17-dihydroxy-16-methyl-5,15,18-trioxo-6-phenylmethoxy-2,4,14,19-tetraoxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadecan-12-yl] benzoate
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CCCC(=O)Nc1ccc(C(=O)NNC(=S)NC(=O)c2ccc(OCCC(C)C)cc2)cc1
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N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]-4-(3-methylbutoxy)benzamide
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Cc1ccoc1CS[C@H]1CCCC[C@@H]1O
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(1S,2S)-2-[(3-methylfuran-2-yl)methylsulfanyl]cyclohexan-1-ol
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COc1ccc(C(=O)N2CCN(c3ccc(C(C)=O)cc3)CC2)c(OC)c1OC
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1-[4-[4-(2,3,4-trimethoxybenzoyl)piperazin-1-yl]phenyl]ethanone
|
C.Cc1ccc(C(C)(C)C)cc1.Cc1ccc(C(C)(C)C)nc1
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1-tert-butyl-4-methylbenzene;2-tert-butyl-5-methylpyridine;methane
|
Cc1ccc(S(=O)(=O)n2c(C)cc3c2C(=O)[C@H](C)C3)cc1
|
(5R)-2,5-dimethyl-1-(4-methylphenyl)sulfonyl-4,5-dihydrocyclopenta[b]pyrrol-6-one
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COc1cccc(Sc2c(Nc3nnc(Cc4cccc(F)c4)o3)ccc3c2C=NC3)c1
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5-[(3-fluorophenyl)methyl]-N-[4-(3-methoxyphenyl)sulfanyl-1H-isoindol-5-yl]-1,3,4-oxadiazol-2-amine
|
CN1CCN(c2cc(C(=O)c3ccccc3)c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cn2)CC1
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4-benzoyl-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
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Cc1cc(C(=O)Oc2cc(C(=O)Oc3cc(C(=O)O[C@H]4[C@H](OC(=O)c5cc(O)c(O)c(OC(=O)c6cc(O)c(O)c(OC(=O)c7cc(O)c(O)c(O)c7)c6)c5)O[C@H](COC(=O)c5cc(O)c(O)c(OC(=O)c6cc(O)c(O)c(OC(=O)c7cc(O)c(O)c(O)c7)c6)c5)[C@@H](OC(=O)c5cc(O)c(O)c(OC(=O)c6cc(O)c(O)c(OC(=O)c7cc(O)c(O)c(O)c7)c6)c5)[C@@H]4OC(=O)c4cc(O)c(O)c(OC(=O)c5cc(O)c(O)c(OC(=O)c6cc(O)c(O)c(O)c6)c5)c4)cc(O)c3O)cc(O)c2O)cc(O)c1O
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[5-[2,3-dihydroxy-5-[(2S,3R,4S,5R,6R)-2,4,5-tris[[3-[3,4-dihydroxy-5-(3,4,5-trihydroxybenzoyl)oxybenzoyl]oxy-4,5-dihydroxybenzoyl]oxy]-6-[[3-[3,4-dihydroxy-5-(3,4,5-trihydroxybenzoyl)oxybenzoyl]oxy-4,5-dihydroxybenzoyl]oxymethyl]oxan-3-yl]oxycarbonylphenoxy]carbonyl-2,3-dihydroxyphenyl] 3,4-dihydroxy-5-methylbenzoate
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CCOc1cc(C=C2SC(=S)N(C)C2=O)ccc1OCc1ccccc1C#N
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2-[[2-ethoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzonitrile
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CCc1nn(C)c(NC2(CO)CCC2)c1[N+](=O)[O-]
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[1-[(5-ethyl-2-methyl-4-nitropyrazol-3-yl)amino]cyclobutyl]methanol
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COc1cc(C=C2SC(=O)N(CC(=O)Nc3ccccc3)C2=O)ccc1Oc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccc(Cl)cc1Cl
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2-[5-[[4-[7-[(2,4-dichlorophenyl)methyl]-1,3-dimethyl-2,6-dioxopurin-8-yl]oxy-3-methoxyphenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-phenylacetamide
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Cc1ccccc1N1C(N)=NCC1c1ccc(O)cc1
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4-[2-amino-3-(2-methylphenyl)-4,5-dihydroimidazol-4-yl]phenol
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