FULL DB

Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )

STK687125
Synonyms: 6-methyl-5-({4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}sulfonyl)pyrimidine-2,4(1H,3H)-dione
Smiles: O=c1[nH]c(C)c(c(=O)[nH]1)S(=O)(=O)N1CCN(CC1)CCc1ccncc1

STK783083
Synonyms: 6-(4-methoxybenzyl)-1-(2-phenylethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)CN1CNc2c(C1)c(=O)[nH]c(=S)n2CCc1ccccc1

STK687128
Synonyms: N-[4-(1H-pyrrol-1-yl)benzyl]pyrazine-2-carboxamide
Smiles: O=C(c1cnccn1)NCc1ccc(cc1)n1cccc1

STK783086
Synonyms: 2-(naphthalen-1-yloxy)-N-[4-(1H-pyrrol-1-yl)benzyl]acetamide
Smiles: O=C(COc1cccc2c1cccc2)NCc1ccc(cc1)n1cccc1

STK687129
Synonyms: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(5-chloropyridin-2-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)[N+](=O)[O-])Nc1ccc(cn1)Cl

STK783088
Synonyms: 3-(3,4-dimethoxyphenyl)-N-[4-(1H-pyrrol-1-yl)benzyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NCc1ccc(cc1)n1cccc1

STK783089
Synonyms: N-(1-benzyl-3-methyl-1H-pyrazol-5-yl)-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1cc(nn1Cc1ccccc1)C

STK783092
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)-2-oxo-2H-chromene-3-carboxamide
Smiles: O=C(c1cc2ccccc2oc1=O)Nc1cccc2c1non2

STK687130
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-(4-methoxybenzyl)-1,2,4-oxadiazole
Smiles: COc1ccc(cc1)Cc1onc(n1)c1ccc2c(c1)OCO2

STK687131
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-[(4-fluorophenoxy)methyl]-1,2,4-oxadiazole
Smiles: Fc1ccc(cc1)OCc1onc(n1)c1ccc2c(c1)OCO2

STK783097
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-[(2-chlorophenoxy)methyl]-1,2,4-oxadiazole
Smiles: Clc1ccccc1OCc1onc(n1)c1ccc2c(c1)OCO2

STK783098
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-1,2,4-oxadiazole
Smiles: Fc1ccc(cc1)c1onc(n1)c1ccc2c(c1)OCO2

STK783099
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-(2-fluorophenyl)-1,2,4-oxadiazole
Smiles: Fc1ccccc1c1onc(n1)c1ccc2c(c1)OCO2

STK783101
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-[(3-chlorophenoxy)methyl]-1,2,4-oxadiazole
Smiles: Clc1cccc(c1)OCc1onc(n1)c1ccc2c(c1)OCO2

STK783102
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-(5-bromofuran-2-yl)-1,2,4-oxadiazole
Smiles: Brc1ccc(o1)c1onc(n1)c1ccc2c(c1)OCO2

STK783103
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-(thiophen-2-yl)-1,2,4-oxadiazole
Smiles: c1csc(c1)c1onc(n1)c1ccc2c(c1)OCO2

STK783104
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-(furan-2-yl)-1,2,4-oxadiazole
Smiles: c1coc(c1)c1onc(n1)c1ccc2c(c1)OCO2

STK783105
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-(phenoxymethyl)-1,2,4-oxadiazole
Smiles: c1ccc(cc1)OCc1onc(n1)c1ccc2c(c1)OCO2

STK783106
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-(2-phenylethyl)-1,2,4-oxadiazole
Smiles: c1ccc(cc1)CCc1onc(n1)c1ccc2c(c1)OCO2

STK687134
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-(2-phenylcyclopropyl)-1,2,4-oxadiazole
Smiles: c1ccc(cc1)C1CC1c1onc(n1)c1ccc2c(c1)OCO2

STK687138
Synonyms: 5-[(1,2,2,6,6-pentamethylpiperidin-4-yl)carbamoyl]-1H-imidazole-4-carboxylicacid
Smiles: CN1C(C)(C)CC(CC1(C)C)NC(=O)c1[nH]cnc1C(=O)O

STK783112
Synonyms: 6-benzyl-5-hydroxy-7-methyl[1,3]thiazolo[4,5-b]pyridin-2(3H)-one
Smiles: Oc1nc2[nH]c(=O)sc2c(c1Cc1ccccc1)C

STK687140
Synonyms: 6-benzyl-7-methyl-2-oxo-2,3-dihydro[1,3]thiazolo[4,5-b]pyridin-5-ylacetate
Smiles: CC(=O)Oc1nc2[nH]c(=O)sc2c(c1Cc1ccccc1)C

STK783116
Synonyms: dimethyl5-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)C(=O)OC)NC(=O)c1cnn(c1C)C

STK783119
Synonyms: 1,5-dimethyl-N-[4-(1,2-oxazol-5-yl)phenyl]-1H-pyrazole-4-carboxamide
Smiles: O=C(c1cnn(c1C)C)Nc1ccc(cc1)c1ccno1

STK783121
Synonyms: 4-cyclopropyl-1,3-dimethyl-N-[4-(1,2-oxazol-5-yl)phenyl]-1H-pyrazolo[3,4-b]pyridine-6-carboxamide
Smiles: O=C(c1cc(C2CC2)c2c(n1)n(C)nc2C)Nc1ccc(cc1)c1ccno1

STK783122
Synonyms: N-(4-fluorophenyl)quinoxaline-2-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1cnc2c(n1)cccc2

STK783125
Synonyms: N-(2-fluorophenyl)quinoxaline-2-carboxamide
Smiles: O=C(c1cnc2c(n1)cccc2)Nc1ccccc1F

STK687141
Synonyms: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]acetamide
Smiles: O=C(Nc1nc2c(s1)cc(cc2)S(=O)(=O)C)CN1CCN(CC1)c1cccc(c1)Cl

STK783126
Synonyms: (5E)-3-(4-amino-1,2,5-oxadiazol-3-yl)-2-imino-5-{[3-(2-methylpropyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-1,3-thiazolidin-4-one
Smiles: CC(Cc1nn(cc1/C=C\1/SC(=N)N(C1=O)c1nonc1N)c1ccccc1)C

STK783128
Synonyms: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(4-chloro-1H-pyrazol-1-yl)ethanone
Smiles: Clc1cnn(c1)C(=O)Cn1nc(c(c1C)Br)[N+](=O)[O-]

STK783133
Synonyms: N-(4-methoxyphenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1n[nH]c2c1CCC2

STK783134
Synonyms: 3-[(phenylsulfonyl)methyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)CS(=O)(=O)c1ccccc1)NCC12CC3CC(C2)CC(C1)C3

STK783135
Synonyms: 2-(thiophen-2-yl)-N-[2-(trifluoromethyl)-1H-benzimidazol-4-yl]acetamide
Smiles: O=C(Nc1cccc2c1nc([nH]2)C(F)(F)F)Cc1cccs1

STK783136
Synonyms: N-(3,5-dimethoxybenzyl)-2-(trifluoromethyl)-1H-benzimidazol-7-amine
Smiles: COc1cc(CNc2cccc3c2[nH]c(n3)C(F)(F)F)cc(c1)OC

STK783137
Synonyms: N-(4-methoxybenzyl)-2-methyl-1H-benzimidazol-7-amine
Smiles: COc1ccc(cc1)CNc1cccc2c1[nH]c(n2)C

STK783139
Synonyms: 4-fluoro-N-[2-(pyridin-4-yl)ethyl]benzamide
Smiles: Fc1ccc(cc1)C(=O)NCCc1ccncc1

STK783140
Synonyms: 2-amino-1-(3-chlorophenyl)-5-oxo-4-[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)Cl)C2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CCC2

STK783141
Synonyms: 2-amino-1-(4-chlorophenyl)-7,7-dimethyl-5-oxo-4-[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2)Cl)C2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CC(C2)(C)C

STK687147
Synonyms: (3-amino-8-methyl-1,4-diazaspiro[4.5]dec-3-en-2-ylidene)propanedinitrile
Smiles: N#CC(=C1NC2(N=C1N)CCC(CC2)C)C#N

STK783150
Synonyms: 2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N-[4-(1H-pyrrol-1-yl)benzyl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)C)NCc1ccc(cc1)n1cccc1

STK783155
Synonyms: N-[4-(1H-pyrrol-1-yl)benzyl]pyridine-4-carboxamide
Smiles: O=C(c1ccncc1)NCc1ccc(cc1)n1cccc1

STK687150
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-[4-(1H-pyrrol-1-yl)benzyl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1ccc(cc1)n1cccc1

STK687151
Synonyms: 2-methyl-N-[4-(1H-pyrrol-1-yl)benzyl]quinoline-4-carboxamide
Smiles: Cc1nc2ccccc2c(c1)C(=O)NCc1ccc(cc1)n1cccc1

STK783158
Synonyms: N-(1-benzyl-3-methyl-1H-pyrazol-5-yl)-2-(4-fluorophenoxy)acetamide
Smiles: O=C(Nc1cc(nn1Cc1ccccc1)C)COc1ccc(cc1)F

STK783159
Synonyms: N-(1-benzyl-3-methyl-1H-pyrazol-5-yl)pyridine-3-carboxamide
Smiles: Cc1cc(n(n1)Cc1ccccc1)NC(=O)c1cccnc1

STK783163
Synonyms: 3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: NC(=O)c1onc(n1)c1ccc(cc1)n1cccc1

STK783171
Synonyms: 3-(5-bromofuran-2-yl)-N-(2-fluorobenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Brc1ccc(o1)c1noc(n1)C(=O)NCc1ccccc1F

STK783174
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-{[(4-chlorophenyl)sulfonyl]methyl}-1,2,4-oxadiazole-5-carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1ccc2c(c1)OCO2

STK783176
Synonyms: 3-{[(4-chlorophenyl)sulfonyl]methyl}-N-(pyridin-3-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1cccnc1

STK783177
Synonyms: 3-{[(4-chlorophenyl)sulfonyl]methyl}-N-[2-(2-methoxyphenyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1ccccc1CCNC(=O)c1onc(n1)CS(=O)(=O)c1ccc(cc1)Cl

STK783179
Synonyms: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethylS-benzyl-N-(phenylcarbonyl)cysteinate
Smiles: O=C(Nc1nnc(s1)C)COC(=O)C(NC(=O)c1ccccc1)CSCc1ccccc1

STK783180
Synonyms: 5-chloro-7-methyl[1,2,4]triazolo[4,3-a]pyrimidine
Smiles: Cc1cc(Cl)n2c(n1)nnc2

STK687156
Synonyms: ethyl6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(4-methoxyphenoxy)methyl]-1-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(COc2ccc(cc2)OC)n(c2c1c(CN(C)C)c(O)c(c2)Br)C

STK783182
Synonyms: 2-[3-ethoxy-5-iodo-4-(prop-2-yn-1-yloxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one
Smiles: C#CCOc1c(I)cc(cc1OCC)C1NC(=O)c2c(O1)cccc2

STK687158
Synonyms: 7-(ethoxycarbonyl)-2,3-dihydrofuro[3,4-b][1,4]dioxine-5-carboxylicacid
Smiles: CCOC(=O)c1oc(c2c1OCCO2)C(=O)O

STK687164
Synonyms: 6-chloro-1,3-benzodioxole-5-carbonitrile
Smiles: N#Cc1cc2OCOc2cc1Cl

STK687168
Synonyms: 2-{[5-(4-methylphenyl)-2H-tetrazol-2-yl]methyl}quinazolin-4(1H)-one
Smiles: Cc1ccc(cc1)c1nnn(n1)Cc1nc(=O)c2c([nH]1)cccc2

STK687169
Synonyms: 4-cyclopropyl-N-(4-fluorobenzyl)-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-6-carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1cc(C2CC2)c2c(n1)n(C)nc2C

STK687170
Synonyms: methyl4-{[6,7-dichloro-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)Nc1nc2cc(Cl)c(cc2nc1n1nc(cc1C)C)Cl

STK687172
Synonyms: Nalpha-acetyl-N-(furan-2-ylmethyl)tryptophanamide
Smiles: CC(=O)NC(C(=O)NCc1ccco1)Cc1c[nH]c2c1cccc2

STK783196
Synonyms: N-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide
Smiles: O=C(c1ccccc1)Nc1nonc1N1C(=O)c2c(C1=O)cccc2

STK783198
Synonyms: 5,6-dimethyl-3-(pyridin-4-yl)-1,2,4-triazine
Smiles: Cc1nnc(nc1C)c1ccncc1

STK783199
Synonyms: 3-methoxy-1,2-benzothiazol-5-amine
Smiles: COc1nsc2c1cc(N)cc2

STK783201
Synonyms: methyl5-amino-1-(2-methoxy-5-methylphenyl)-1H-1,2,3-triazole-4-carboxylate
Smiles: COC(=O)c1nnn(c1N)c1cc(C)ccc1OC

STK783203
Synonyms: 1-(3-methylphenyl)-4-phenyl-1H-1,2,3-triazol-5-amine
Smiles: Cc1cccc(c1)n1nnc(c1N)c1ccccc1

STK783204
Synonyms: 2-{[5-(4-hydroxybenzyl)-4-methyl-1H-imidazol-2-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
Smiles: O=C(Nc1nnc(s1)C)CSc1nc(c([nH]1)Cc1ccc(cc1)O)C

STK783209
Synonyms: N-(3-methoxyphenyl)-5-(4-nitro-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-amine
Smiles: COc1cccc(c1)Nc1nnc([nH]1)c1[nH]ncc1[N+](=O)[O-]

STK783210
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-amine
Smiles: [O-][N+](=O)c1cn[nH]c1c1nnc([nH]1)Nc1ccc2c(c1)OCCO2

STK687173
Synonyms: 3-amino-7-fluoro-6-(4-methylpiperazin-1-yl)quinoxaline-2-carbonitrile
Smiles: CN1CCN(CC1)c1cc2nc(N)c(nc2cc1F)C#N

STK783212
Synonyms: 1-(4-chlorophenyl)-7,7-dimethyl-N-(3-methylpent-1-yn-3-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CCC(NC(=O)c1cc2C(=O)CC(Cc2n(c1=O)c1ccc(cc1)Cl)(C)C)(C#C)C

STK687174
Synonyms: {[6-cyclopentyl-1-(furan-2-ylmethyl)-4-oxo-1,4,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-2-yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc(=O)c2c(n1Cc1ccco1)NCN(C2)C1CCCC1

STK783216
Synonyms: 2-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: O=C(c1cc2CCCCc2[nH]c1=O)NCCc1ccc(cc1)S(=O)(=O)N

STK687178
Synonyms: ethyl4-[(1-hydroxypropan-2-yl)amino]-8-methoxyquinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1NC(CO)C)cccc2OC

STK687179
Synonyms: ethyl8-methoxy-4-(piperazin-1-yl)quinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1N1CCNCC1)cccc2OC

STK783218
Synonyms: ethyl4-(cyclopropylamino)-6,7-difluoroquinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1NC1CC1)cc(c(c2)F)F

STK687181
Synonyms: 4-methoxy-7-oxo-7,13-dihydrobenzimidazo[1,2-b]benzo[f][2,7]naphthyridine-14-carbonitrile
Smiles: COc1cccc2c1ncc1c2c(C#N)c2n(c1=O)c1c([nH]2)cccc1

STK783219
Synonyms: (1R,2R,5S)-2-(3-{[2-(2,4-dichlorobenzyl)-2H-tetrazol-5-yl]methyl}-4-methyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: O=C1C[C@H]([C@H]2O[C@@H]1OC2)n1nc(n(c1=S)C)Cc1nnn(n1)Cc1ccc(cc1Cl)Cl

STK783222
Synonyms: 6,7-dichloro-3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(pyridin-4-ylmethyl)quinoxalin-2-amine
Smiles: Cc1nn(c(c1)C)c1nc2cc(Cl)c(cc2nc1NCc1ccncc1)Cl

STK687184
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-(5-bromofuran-2-yl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Brc1ccc(o1)c1noc(n1)C(=O)NCc1ccc2c(c1)OCO2

STK783224
Synonyms: 3-(5-bromofuran-2-yl)-N-(pyridin-3-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Brc1ccc(o1)c1noc(n1)C(=O)NCc1cccnc1

STK687185
Synonyms: 3-(5-bromofuran-2-yl)-N-(pyridin-4-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Brc1ccc(o1)c1noc(n1)C(=O)NCc1ccncc1

STK783225
Synonyms: 3-(5-bromofuran-2-yl)-N-[2-(2-methoxyphenyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1ccccc1CCNC(=O)c1onc(n1)c1ccc(o1)Br

STK783226
Synonyms: 3-(5-bromofuran-2-yl)-N-(3-fluorobenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Fc1cccc(c1)CNC(=O)c1onc(n1)c1ccc(o1)Br

STK783227
Synonyms: 3-{[(4-chlorophenyl)sulfonyl]methyl}-N-(pyridin-4-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1ccncc1

STK783228
Synonyms: 3-{[(4-chlorophenyl)sulfonyl]methyl}-N-(2-fluorobenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1ccccc1F

STK783229
Synonyms: 3-{[(4-chlorophenyl)sulfonyl]methyl}-N-(3-fluorobenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1cccc(c1)F

STK687186
Synonyms: 6-(4-methoxyphenyl)-7-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: COc1ccc(cc1)C1=Nn2cnnc2SC1C

STK783230
Synonyms: 2-amino-3-[(4-chlorophenyl)carbonyl]indolizine-1-carboxamide
Smiles: Clc1ccc(cc1)C(=O)c1c(N)c(c2n1cccc2)C(=O)N

STK687187
Synonyms: 6-tert-butyl[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Smiles: O=c1[nH]c2nncn2nc1C(C)(C)C

STK783232
Synonyms: 5-[2-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2-methyl[1,2,4]triazino[2,3-a]benzimidazol-3(5H)-one
Smiles: O=C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)Cn1c2nc(=O)c(nn2c2c1cccc2)C

STK783234
Synonyms: 10-(furan-2-ylmethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-7,8-dicarbonitrile
Smiles: N#Cc1cc2c(cc1C#N)Sc1c(C(=O)N2Cc2ccco2)cccc1

STK687189
Synonyms: 1-[2-methoxy-5-(methylsulfanyl)thiophen-3-yl]propan-2-amine
Smiles: COc1sc(cc1CC(N)C)SC

STK783235
Synonyms: (Z)-N-hydroxy-1-[2-methoxy-5-(methylsulfanyl)thiophen-3-yl]methanimine
Smiles: O/N=C\c1cc(sc1OC)SC

STK783237
Synonyms: 5-methoxythieno[3,2-d][1,2]thiazole
Smiles: COc1cc2c(s1)snc2

STK687190
Synonyms: 2-methoxy-3,5-bis(methylsulfonyl)thiophene
Smiles: COc1sc(cc1S(=O)(=O)C)S(=O)(=O)C

STK783241
Synonyms: methyl1-(3-chlorobenzyl)-1H-pyrazole-3-carboxylate
Smiles: COC(=O)c1ccn(n1)Cc1cccc(c1)Cl

STK783242
Synonyms: (1R,2R,5S)-2-[3-(4-amino-1,2,5-oxadiazol-3-yl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: O=C1C[C@H]([C@H]2O[C@@H]1OC2)n1nc(n(c1=S)c1ccccc1)c1nonc1N

STK687193
Synonyms: 6-[4-(3,5-dichlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]pyridazin-3(2H)-one
Smiles: Clc1cc(Cl)cc(c1)n1c(S)nnc1c1ccc(=O)[nH]n1

STK783244
Synonyms: 6-[4-(3-chloro-4-fluorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]pyridazin-3(2H)-one
Smiles: O=c1ccc(n[nH]1)c1nnc(n1c1ccc(c(c1)Cl)F)S

STK783245
Synonyms: 6-{4-[2-chloro-5-(trifluoromethyl)phenyl]-5-sulfanyl-4H-1,2,4-triazol-3-yl}pyridazin-3(2H)-one
Smiles: Clc1ccc(cc1n1c(S)nnc1c1ccc(=O)[nH]n1)C(F)(F)F

STK783246
Synonyms: 2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,3,4-oxadiazole
Smiles: Clc1ccc(cc1)c1cc([nH]n1)c1ocnn1

STK783248
Synonyms: N-(3-chloro-4-fluorophenyl)-5-(pyrazin-2-yl)-1,3,4-thiadiazol-2-amine
Smiles: Fc1ccc(cc1Cl)Nc1nnc(s1)c1cnccn1

STK687195
Synonyms: 3-hydroxy-3-[2-(4-methoxyphenyl)-2-oxoethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-indol-2-one
Smiles: COc1ccc(cc1)C(=O)CC1(O)c2ccccc2N(C1=O)Cc1cccc(c1)C(F)(F)F

STK687196
Synonyms: 4-{[4,5-dimethoxy-2-(1H-tetrazol-1-yl)phenyl]sulfonyl}morpholine
Smiles: COc1cc(c(cc1OC)n1cnnn1)S(=O)(=O)N1CCOCC1

STK687197
Synonyms: 3-amino-7-fluoro-6-(morpholin-4-yl)quinoxaline-2-carboxamide1,4-dioxide
Smiles: Fc1cc2c(cc1N1CCOCC1)[n+]([O-])c(c([n+]2[O-])C(=O)N)N

STK687198
Synonyms: 3-amino-7-fluoro-6-(4-methylpiperazin-1-yl)quinoxaline-2-carboxamide1,4-dioxide
Smiles: CN1CCN(CC1)c1cc2[n+]([O-])c(N)c([n+](c2cc1F)[O-])C(=O)N

STK687201
Synonyms: 3-amino-7-fluoro-6-(pyrrolidin-1-yl)quinoxaline-2-carboxamide1,4-dioxide
Smiles: Fc1cc2c(cc1N1CCCC1)[n+]([O-])c(c([n+]2[O-])C(=O)N)N

STK687204
Synonyms: 4-methoxy-8,13-dihydro-7H-quino[4,3-b][1,5]benzodiazepin-7-one
Smiles: COc1cccc2c1ncc1c2[nH]c2ccccc2[nH]c1=O

STK783252
Synonyms: 2-amino-4-(1-ethyl-1H-pyrazol-4-yl)-6-methoxypyridine-3,5-dicarbonitrile
Smiles: CCn1ncc(c1)c1c(C#N)c(N)nc(c1C#N)OC

STK783253
Synonyms: 3-amino-1-(1-ethyl-1H-pyrazol-4-yl)-1H-benzo[f]chromene-2-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cnn(c1)CC)c1ccccc1cc2

STK783254
Synonyms: (1S,2S,5R)-2-[5-(thiophen-2-yl)-2-thioxo-1,3,4-oxadiazol-3(2H)-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nc(oc1=S)c1cccs1

STK783255
Synonyms: 2-[4-oxo-4-(1H-pyrazol-1-yl)butyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(n1cccn1)CCCN1C(=O)c2c(C1=O)cccc2

STK687205
Synonyms: (3E)-4-{[2-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-yl]amino}pent-3-en-2-one
Smiles: COCc1cc(C)nc2c1c(N/C(=C/C(=O)C)/C)c(s2)N

STK687207
Synonyms: 8-(methoxymethyl)-6-methyl-3-phenyl-1H-pyrazolo[3',4':4,5]thieno[2,3-b]pyridine
Smiles: COCc1cc(C)nc2c1c1[nH]nc(c1s2)c1ccccc1

STK783257
Synonyms: 1-(3,5-diamino-1H-1,2,4-triazol-1-yl)ethanone
Smiles: CC(=O)n1nc(nc1N)N

STK687209
Synonyms: 2-amino-5-chloro-N-(3-fluorophenyl)benzamide
Smiles: Fc1cccc(c1)NC(=O)c1cc(Cl)ccc1N

STK687210
Synonyms: {[2-chloro-4-(trifluoromethyl)phenyl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1ccc(cc1Cl)C(F)(F)F

STK687211
Synonyms: 3-nitropyridin-4-ol1-oxide
Smiles: [O-][n+]1ccc(c(c1)[N+](=O)[O-])O

STK783258
Synonyms: 5-bromo-3-methylpyridin-2-ol
Smiles: Brc1cnc(c(c1)C)O

STK687214
Synonyms: 4-(N,N-dimethylcarbamimidoyl)benzoicacid
Smiles: CN(C(=N)c1ccc(cc1)C(=O)O)C

STK687215
Synonyms: 2-methoxy-4,6-dinitrophenol
Smiles: COc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-]

STK687216
Synonyms: 5-(phenylsulfonyl)benzene-1,3-diamine
Smiles: Nc1cc(N)cc(c1)S(=O)(=O)c1ccccc1

STK687220
Synonyms: 3,5-bis(phenylsulfanyl)aniline
Smiles: Nc1cc(cc(c1)Sc1ccccc1)Sc1ccccc1

STK687222
Synonyms: 2-[(3,5-dinitrophenyl)sulfanyl]propanoicacid
Smiles: OC(=O)C(Sc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])C

STK783260
Synonyms: N-(4-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazole-4-carboxamide
Smiles: O=C1Nc2nc3c(n2C(C1)C(=O)Nc1ccc(cc1)F)cccc3

STK783261
Synonyms: 2-oxo-2-(phenylamino)ethyl2,3-di(furan-2-yl)quinoxaline-6-carboxylate
Smiles: O=C(Nc1ccccc1)COC(=O)c1ccc2c(c1)nc(c(n2)c1ccco1)c1ccco1

STK687226
Synonyms: N-{2-[4-(5-chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)piperazin-1-yl]-2-oxoethyl}-N-(4-methoxyphenyl)ethanesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)CC)CC(=O)N1CCN(CC1)c1cnn(c(=O)c1Cl)c1ccccc1

STK783264
Synonyms: 3-chloro-N-[2-(3,4-dimethoxyphenyl)-3-phenylpropyl]-1-benzothiophene-2-carboxamide
Smiles: COc1cc(ccc1OC)C(Cc1ccccc1)CNC(=O)c1sc2c(c1Cl)cccc2

STK783265
Synonyms: 2-amino-6-ethyl-5-methyl-4-(1-methyl-1H-pyrrol-2-yl)pyridine-3-carbonitrile
Smiles: CCc1nc(N)c(c(c1C)c1cccn1C)C#N

STK687227
Synonyms: 4-methyl-2-{4-[(4-methylpiperazin-1-yl)carbonyl]phenyl}phthalazin-1(2H)-one
Smiles: CN1CCN(CC1)C(=O)c1ccc(cc1)n1nc(C)c2c(c1=O)cccc2

STK687233
Synonyms: 2-(5-methoxy-1H-indol-3-yl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1c[nH]c2c1cc(OC)cc2)CCC

STK687234
Synonyms: (2E)-2-{[4-(azepan-1-ylmethyl)thiophen-2-yl]methylidene}hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1scc(c1)CN1CCCCCC1

STK687236
Synonyms: 8-amino-N-(3-chloro-4-fluorophenyl)-3,4-dihydro-2H-1,4-ethanothieno[2,3-b][1,5]naphthyridine-7-carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)C2CCN1CC2)Nc1ccc(c(c1)Cl)F

STK783269
Synonyms: 1-benzyl-1,10b-dimethyl-1,5,6,10b-tetrahydro[1,3]oxazolo[4,3-a]isoquinolin-3-one
Smiles: O=C1OC(C2(N1CCc1c2cccc1)C)(C)Cc1ccccc1

STK687240
Synonyms: 8-amino-N-[4-(dimethylamino)phenyl]-3,4-dihydro-2H-1,4-ethanothieno[2,3-b][1,5]naphthyridine-7-carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)C2CCN1CC2)Nc1ccc(cc1)N(C)C

STK783279
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])NCCc1nc2c([nH]1)cccc2

STK783280
Synonyms: N-(propan-2-yl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: CC(NC(=O)c1onc(n1)c1ccc(cc1)n1cccc1)C

STK687242
Synonyms: 8-methyl-3-(propan-2-yl)-1,2,3,4,8,9-hexahydro-5H-pyrimido[5,4-e][1,3]thiazolo[3,2-a]pyrimidin-5-one
Smiles: CC1Cn2c(S1)nc(=O)c1c2NCN(C1)C(C)C

STK687243
Synonyms: {[6-amino-1-(4-methoxyphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc(=O)cc(n1c1ccc(cc1)OC)N

STK783283
Synonyms: N-(5-{[2-(4-amino-2-oxido-1,2,5-oxadiazol-3-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Smiles: [O-][n+]1onc(c1C(=O)CSc1nnc(s1)NC(=O)C)N

STK783284
Synonyms: 2-methoxy-5-nitro-6-oxo-1,6-dihydropyridine-3-carbonitrile
Smiles: N#Cc1cc([N+](=O)[O-])c(=O)[nH]c1OC

STK783285
Synonyms: 3-benzyl-7-(piperidin-1-yl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Smiles: C1CCN(CC1)c1ncnc2c1nnn2Cc1ccccc1

STK687244
Synonyms: 7-(4-chlorophenyl)-3-methyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Smiles: Clc1ccc(cc1)c1cc(=O)n2c(s1)nnc2C

STK783289
Synonyms: 3,5-dibenzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol
Smiles: Oc1nc(Cc2ccccc2)nc2c1nnn2Cc1ccccc1

STK783290
Synonyms: ethyl1-({(3E)-3-[2-(2-fluorophenyl)hydrazinylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}methyl)piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CN1c2ccccc2/C(=N\Nc2ccccc2F)/C1=O

STK687249
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-methyl-3-propyl-1H-pyrazole-5-carboxamide
Smiles: CCCc1cc(n(n1)C)C(=O)Nc1c(=O)n(n(c1C)C)c1ccccc1

STK687250
Synonyms: N-{2-[(4-chlorophenyl)carbamoyl]phenyl}-1-methyl-3-propyl-1H-pyrazole-5-carboxamide
Smiles: CCCc1cc(n(n1)C)C(=O)Nc1ccccc1C(=O)Nc1ccc(cc1)Cl

STK783294
Synonyms: dimethyl5-{[(1-methyl-3-propyl-1H-pyrazol-5-yl)carbonyl]amino}benzene-1,3-dicarboxylate
Smiles: CCCc1cc(n(n1)C)C(=O)Nc1cc(cc(c1)C(=O)OC)C(=O)OC

STK783295
Synonyms: 1-methyl-N-(naphthalen-1-yl)-3-propyl-1H-pyrazole-5-carboxamide
Smiles: CCCc1nn(c(c1)C(=O)Nc1cccc2c1cccc2)C

STK783297
Synonyms: 3-cyclopropyl-1-methyl-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1C)C1CC1)NC12CC3CC(C2)CC(C1)C3

STK783301
Synonyms: 3-cyclopropyl-1-methyl-N-{2-[(2-phenoxyethyl)carbamoyl]phenyl}-1H-pyrazole-5-carboxamide
Smiles: O=C(c1ccccc1NC(=O)c1cc(nn1C)C1CC1)NCCOc1ccccc1

STK687252
Synonyms: 3-cyclopropyl-1-methyl-N-(2-phenylethyl)-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1C)C1CC1)NCCc1ccccc1

STK783303
Synonyms: 3-cyclopropyl-N-(3,5-dimethyltricyclo[3.3.1.1~3,7~]dec-1-yl)-1-methyl-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1C)C1CC1)NC12CC3CC(C2)(CC(C1)(C3)C)C

STK783304
Synonyms: 3-cyclopropyl-1-methyl-N-(tricyclo[3.3.1.1~3,7~]dec-2-yl)-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1C)C1CC1)NC1C2CC3CC1CC(C2)C3

STK783305
Synonyms: [4-(2-fluorophenyl)piperazin-1-yl][1-methyl-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-5-yl]methanone
Smiles: O=C(c1cc(nn1C)C12CC3CC(C2)CC(C1)C3)N1CCN(CC1)c1ccccc1F

STK783306
Synonyms: N-cyclopropyl-1-methyl-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1C)C12CC3CC(C2)CC(C1)C3)NC1CC1

STK687253
Synonyms: N-cyclohexyl-1-methyl-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1C)C12CC3CC(C2)CC(C1)C3)NC1CCCCC1

STK687254
Synonyms: 2-[5-(1,3-benzodioxol-5-yloxy)-3-nitro-1H-1,2,4-triazol-1-yl]-1-(morpholin-4-yl)ethanone
Smiles: O=C(N1CCOCC1)Cn1nc(nc1Oc1ccc2c(c1)OCO2)[N+](=O)[O-]

STK783308
Synonyms: 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(4-ethylphenyl)benzamide
Smiles: CCc1ccc(cc1)NC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1

STK783312
Synonyms: N-(3-methoxyphenyl)hexopyranosylamine
Smiles: OCC1OC(Nc2cccc(c2)OC)C(C(C1O)O)O

STK783313
Synonyms: 6-methyl-4-phenyl-3,4-dihydropyrido[3',2':5,6]pyrimido[1,2-a]benzimidazole-2,5(1H,6H)-dione
Smiles: O=C1CC(c2ccccc2)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783314
Synonyms: 4-amino-5-(phenylcarbonyl)-1,2-oxazole-3-carbonitrile
Smiles: N#Cc1noc(c1N)C(=O)c1ccccc1

STK687255
Synonyms: dimethyl2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-5-nitrobenzene-1,4-dicarboxylate
Smiles: COC(=O)c1cc([N+](=O)[O-])c(cc1Sc1nc(C)cc(n1)C)C(=O)OC

STK687256
Synonyms: methyl4-bromoselenopheno[2,3-b]selenophene-2-carboxylate
Smiles: COC(=O)c1[se]c2c(c1)c(c[se]2)Br

STK783315
Synonyms: methyl2-amino-5-cyano-6-ethyl-4-(pyridin-3-yl)-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(N)OC(=C(C1c1cccnc1)C#N)CC

STK783319
Synonyms: N-(4-chloro-2,5-dimethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
Smiles: COc1cc(Cl)c(cc1NC(=O)c1scnc1C)OC

STK687260
Synonyms: [4-(1,3-benzoxazol-2-yl)piperidin-1-yl](4-methyl-1,3-thiazol-5-yl)methanone
Smiles: Cc1ncsc1C(=O)N1CCC(CC1)c1nc2c(o1)cccc2

STK783320
Synonyms: N-[4-(acetylamino)phenyl]-2,3-dihydrofuro[3,4-b][1,4]dioxine-5-carboxamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)c1occ2c1OCCO2

STK783321
Synonyms: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl](2,3-dihydrofuro[3,4-b][1,4]dioxin-5-yl)methanone
Smiles: O=C(c1occ2c1OCCO2)N1CCN(CC1)c1nc2c(o1)cccc2

STK783323
Synonyms: N-(4-chloro-2,5-dimethoxyphenyl)-2,3-dihydrofuro[3,4-b][1,4]dioxine-5-carboxamide
Smiles: COc1cc(Cl)c(cc1NC(=O)c1occ2c1OCCO2)OC

STK687263
Synonyms: 3-acetyl-2-[(1,3-benzodioxol-5-ylmethyl)amino]-6-methyl-4H-pyran-4-one
Smiles: Cc1cc(=O)c(c(o1)NCc1ccc2c(c1)OCO2)C(=O)C

STK783325
Synonyms: (2E)-2-{[4-(1H-benzimidazol-1-ylmethyl)-5-methylthiophen-2-yl]methylidene}hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1cc(c(s1)C)Cn1cnc2c1cccc2

STK783332
Synonyms: N-(2,4-difluorophenyl)-1,5-dimethyl-1H-pyrazole-4-carboxamide
Smiles: Fc1ccc(c(c1)F)NC(=O)c1cnn(c1C)C

STK783333
Synonyms: N-[2-(4-methoxyphenyl)ethyl]-1,5-dimethyl-1H-pyrazole-4-carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)c1cnn(c1C)C

STK783335
Synonyms: 4-cyclopropyl-N-(3,4-dimethoxybenzyl)-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-6-carboxamide
Smiles: COc1ccc(cc1OC)CNC(=O)c1cc(C2CC2)c2c(n1)n(C)nc2C

STK783340
Synonyms: 5-bromo-N-[2-(pyridin-4-yl)ethyl]furan-2-carboxamide
Smiles: Brc1ccc(o1)C(=O)NCCc1ccncc1

STK783341
Synonyms: diethyl[4-({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)benzyl]phosphonate
Smiles: CCOP(=O)(Cc1ccc(cc1)NC(=O)c1c(C)onc1c1ccccc1Cl)OCC

STK783342
Synonyms: methylN-({[5-(4-hydroxybenzyl)-4-methyl-1H-imidazol-2-yl]sulfanyl}acetyl)leucinate
Smiles: COC(=O)C(NC(=O)CSc1nc(c([nH]1)Cc1ccc(cc1)O)C)CC(C)C

STK783348
Synonyms: methylN-({[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)leucinate
Smiles: COC(=O)C(NC(=O)CSc1nc(=O)cc(n1CCc1ccccc1)N)CC(C)C

STK687266
Synonyms: 2-[4-(2,5-dimethyl-1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(C(=O)c2c1cccc2)c1nonc1n1c(C)ccc1C

STK687267
Synonyms: 3-[5-(4-chlorophenyl)-4-phenyl-1H-imidazol-2-yl]pyridine
Smiles: Clc1ccc(cc1)c1[nH]c(nc1c1ccccc1)c1cccnc1

STK783350
Synonyms: 3-[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]pyridine
Smiles: COc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)OC)c1cccnc1

STK783357
Synonyms: naphthalen-2-yl(5-methyl-3-nitro-1H-pyrazol-1-yl)acetate
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])Oc1ccc2c(c1)cccc2

STK783360
Synonyms: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(3-methoxybenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cccc(c1)CNC(=O)c1onc(n1)Cn1nc(c(c1C)Br)C

STK783361
Synonyms: methyl4-{[({3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazol-5-yl}carbonyl)amino]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)CNC(=O)c1onc(n1)Cn1ncc(c1)[N+](=O)[O-]

STK783365
Synonyms: 3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-[4-(1H-pyrrol-1-yl)benzyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCc1ccc(cc1)n1cccc1

STK783367
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propyl]-1,2,4-oxadiazole
Smiles: [O-][N+](=O)c1c(C)nn(c1C)CCCc1onc(n1)c1ccc2c(c1)OCO2

STK783368
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-[3-(3-nitro-1H-pyrazol-1-yl)propyl]-1,2,4-oxadiazole
Smiles: [O-][N+](=O)c1ccn(n1)CCCc1onc(n1)c1ccc2c(c1)OCO2

STK783370
Synonyms: N-(3-methoxybenzyl)-3-[(phenylsulfonyl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cccc(c1)CNC(=O)c1onc(n1)CS(=O)(=O)c1ccccc1

STK783371
Synonyms: methyl4-{[({3-[(phenylsulfonyl)methyl]-1,2,4-oxadiazol-5-yl}carbonyl)amino]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)CNC(=O)c1onc(n1)CS(=O)(=O)c1ccccc1

STK783375
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)acetamide
Smiles: N#Cc1c(NC(=O)Cn2nc(c(c2C)Cl)C)sc2c1CCC2

STK783378
Synonyms: 2-(4-fluorophenoxy)-N-[1-(propan-2-yl)-1H-pyrazol-4-yl]acetamide
Smiles: O=C(Nc1cnn(c1)C(C)C)COc1ccc(cc1)F

STK687273
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-[3-(dimethylamino)propyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: CN(CCCNC(=O)c1onc(n1)c1ccc2c(c1)OCO2)C

STK687274
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-[2-(diethylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: CCN(CCNC(=O)c1onc(n1)c1ccc2c(c1)OCO2)CC

STK783381
Synonyms: N-(3-methoxybenzyl)-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cccc(c1)CNC(=O)c1onc(n1)Cn1ncc(c1)[N+](=O)[O-]

STK687275
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-{2-[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-yloxy]ethyl}-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCCO[C@]12C[C@H]3C[C@@H](C2)C[C@@H](C1)C3

STK783382
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole
Smiles: Cc1nn(c(c1Br)C)Cc1onc(n1)c1ccc2c(c1)OCO2

STK783386
Synonyms: 3-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]pyridine
Smiles: c1ccc(cn1)c1onc(n1)c1ccc2c(c1)OCO2

STK783387
Synonyms: 4-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]pyridine
Smiles: n1ccc(cc1)c1onc(n1)c1ccc2c(c1)OCO2

STK783390
Synonyms: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodo-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole
Smiles: Ic1cnn(c1)Cc1onc(n1)c1ccc2c(c1)OCO2

STK687276
Synonyms: 3-[(4-iodo-1H-pyrazol-1-yl)methyl]-N-[2-(pyridin-2-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: Ic1cnn(c1)Cc1noc(n1)C(=O)NCCc1ccccn1

STK783396
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1ccco1

STK687278
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-(pyridin-3-ylmethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1cccnc1

STK783397
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1ccc2c(c1)OCO2

STK783398
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-(2-phenylethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCCc1ccccc1

STK687279
Synonyms: ethyl(4-{[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino}-3,5-dimethyl-1H-pyrazol-1-yl)acetate
Smiles: CCOC(=O)Cn1nc(c(c1C)NC(=O)Cn1nc(c(c1C)Cl)C)C

STK687280
Synonyms: N-(4-fluorobenzyl)-3-{[2-(trifluoromethyl)-1H-benzimidazol-1-yl]methyl}-1,2,4-oxadiazole-5-carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1onc(n1)Cn1c2ccccc2nc1C(F)(F)F

STK783400
Synonyms: N-(furan-2-ylmethyl)-3-{[2-(trifluoromethyl)-1H-benzimidazol-1-yl]methyl}-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1c2ccccc2nc1C(F)(F)F)NCc1ccco1

STK783401
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-{[2-(trifluoromethyl)-1H-benzimidazol-1-yl]methyl}-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1c2ccccc2nc1C(F)(F)F)NCc1ccc2c(c1)OCO2

STK783403
Synonyms: N-(pyridin-4-ylmethyl)-3-{[2-(trifluoromethyl)-1H-benzimidazol-1-yl]methyl}-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1c2ccccc2nc1C(F)(F)F)NCc1ccncc1

STK687283
Synonyms: methyl5-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]-1H-imidazole-4-carboxylate
Smiles: COC(=O)c1nc[nH]c1C(=O)NC1CC(C)(C)NC(C1)(C)C

STK687285
Synonyms: N-(5-chloro-2-hydroxyphenyl)-2,4-dinitrobenzamide
Smiles: Clc1ccc(c(c1)NC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])O

STK783408
Synonyms: 8-chloro-3-phenoxydibenzo[b,f][1,4]oxazepin-11(10H)-one
Smiles: Clc1ccc2c(c1)NC(=O)c1c(O2)cc(cc1)Oc1ccccc1

STK783409
Synonyms: 8-chloro-3-(3-methylphenoxy)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Smiles: Clc1ccc2c(c1)NC(=O)c1c(O2)cc(cc1)Oc1cccc(c1)C

STK687286
Synonyms: 3-(4-chlorophenyl)-3-{[(2,4-dimethoxyphenyl)carbonyl]amino}propanoicacid
Smiles: COc1cc(OC)ccc1C(=O)NC(c1ccc(cc1)Cl)CC(=O)O

STK687287
Synonyms: 3-[(benzylsulfonyl)amino]-3-[4-(cyclopentyloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC1CCCC1)NS(=O)(=O)Cc1ccccc1

STK783411
Synonyms: 1-[2-(4-chlorophenyl)-2-methyl-5-phenyl-1,3,4-oxadiazol-3(2H)-yl]ethanone
Smiles: Clc1ccc(cc1)C1(C)OC(=NN1C(=O)C)c1ccccc1

STK687289
Synonyms: 3-[4-(cyclopentyloxy)phenyl]-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoicacid
Smiles: OC(=O)CC(N1C(=O)c2c(C1=O)cccc2)c1ccc(cc1)OC1CCCC1

STK783414
Synonyms: 1-[4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-1,2,5-oxadiazol-3-yl]-3-phenylurea
Smiles: O=C(Nc1ccccc1)Nc1nonc1N1C(=O)C2C(C1=O)CCCC2

STK687291
Synonyms: 2-{[4-methyl-5-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl}-N-(4-methylpyridin-2-yl)acetamide
Smiles: CC(Cc1[nH]c(nc1C)SCC(=O)Nc1nccc(c1)C)C

STK783416
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-[1-(4-fluorobenzyl)-5-methyl-1H-pyrazol-3-yl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)Nc1nn(c(c1)C)Cc1ccc(cc1)F

STK687292
Synonyms: 2-{[5-(4-hydroxybenzyl)-4-methyl-1H-imidazol-2-yl]sulfanyl}-N-(1-phenylethyl)acetamide
Smiles: O=C(NC(c1ccccc1)C)CSc1nc(c([nH]1)Cc1ccc(cc1)O)C

STK783418
Synonyms: 3-(2-chlorophenyl)-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N,5-dimethyl-1,2-oxazole-4-carboxamide
Smiles: COc1ccc(cc1)c1noc(n1)CN(C(=O)c1c(C)onc1c1ccccc1Cl)C

STK783419
Synonyms: N-(quinolin-5-yl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Smiles: O=C(C1COc2c(O1)cccc2)Nc1cccc2c1cccn2

STK783421
Synonyms: 3-(3-chlorophenoxy)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Smiles: Clc1cccc(c1)Oc1ccc2c(c1)Oc1ccccc1NC2=O

STK783430
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dimethyl-1H-pyrazole-4-carboxamide
Smiles: O=C(c1cnn(c1C)C)Nc1ccc2c(c1)OCCO2

STK687293
Synonyms: 1'-(6-chloropyridazin-3-yl)-1,4'-bipiperidine-4'-carboxamide
Smiles: NC(=O)C1(CCN(CC1)c1ccc(nn1)Cl)N1CCCCC1

STK687294
Synonyms: ethyl3-amino-1-(phenylcarbonyl)-5-[(phenylcarbonyl)oxy]-1H-pyrazole-4-carboxylate
Smiles: CCOC(=O)c1c(N)nn(c1OC(=O)c1ccccc1)C(=O)c1ccccc1

STK783435
Synonyms: N-[2-(2-chlorophenoxy)ethyl]-1-methyl-3-propyl-1H-pyrazole-5-carboxamide
Smiles: CCCc1nn(c(c1)C(=O)NCCOc1ccccc1Cl)C

STK783436
Synonyms: 2-oxo-2,3-dihydro-1H-benzimidazole-5,6-dicarbonitrile
Smiles: N#Cc1cc2[nH]c(=O)[nH]c2cc1C#N

STK783437
Synonyms: N-(3-chloro-4-methoxyphenyl)-5-(pyridin-4-yl)-1,3,4-thiadiazol-2-amine
Smiles: COc1ccc(cc1Cl)Nc1nnc(s1)c1ccncc1

STK687297
Synonyms: N-(3-chloro-4-methoxyphenyl)-5-(pyridin-3-yl)-1,3,4-thiadiazol-2-amine
Smiles: COc1ccc(cc1Cl)Nc1nnc(s1)c1cccnc1

STK783441
Synonyms: 4-(4-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-5-methylthiophen-2-yl)-2-methyl-5-oxo-N-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: Nc1nnc(s1)SCc1cc(sc1C)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)Nc1ccccc1

STK783442
Synonyms: methyl4-[4-(1H-benzimidazol-1-ylmethyl)-5-methylthiophen-2-yl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COC(=O)C1=C(C)NC2=C(C1c1sc(c(c1)Cn1cnc3c1cccc3)C)C(=O)CCC2

STK783445
Synonyms: 2-amino-1-(5-methyl-1,2-oxazol-3-yl)-5-oxo-4-[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2noc(c2)C)C2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CCC2

STK783447
Synonyms: N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(1H-tetrazol-1-yl)propanamide
Smiles: O=C(Nc1sc(c(n1)C)C)CCn1cnnn1

STK783450
Synonyms: ethyl6-amino-3-butyl-5-cyano-1'H,7H-spiro[1,2-oxazolo[3,4-b]pyridine-4,4'-piperidine]-1'-carboxylate
Smiles: CCCCc1onc2c1C1(CCN(CC1)C(=O)OCC)C(=C(N2)N)C#N

STK783451
Synonyms: N-(3-ethoxy-4-methoxybenzyl)-2-(trifluoromethyl)-1H-benzimidazol-7-amine
Smiles: CCOc1cc(ccc1OC)CNc1cccc2c1[nH]c(n2)C(F)(F)F

STK783452
Synonyms: N-(3-ethoxy-4-methoxybenzyl)-2-methyl-1H-benzimidazol-7-amine
Smiles: CCOc1cc(CNc2cccc3c2[nH]c(n3)C)ccc1OC

STK783456
Synonyms: 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)Nc1nccs1

STK783458
Synonyms: ethyl5-[({[2,4-dichloro-5-(cyclopropylsulfamoyl)phenyl]carbonyl}amino)methyl]furan-2-carboxylate
Smiles: CCOC(=O)c1ccc(o1)CNC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1

STK687302
Synonyms: 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)NCCc1c(C)[nH]c2c1cccc2

STK687303
Synonyms: 2-amino-4-[4-(azepan-1-ylmethyl)thiophen-2-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1scc(c1)CN1CCCCCC1)C(=O)CCC2

STK687304
Synonyms: (2-hydroxypyridin-3-yl)(oxo)aceticacid
Smiles: Oc1ncccc1C(=O)C(=O)O

STK687305
Synonyms: 1-ethyl-2,3-dimethylpiperidin-4-ol
Smiles: CCN1CCC(C(C1C)C)O

STK687306
Synonyms: 1-[2-(3,4-dimethoxyphenyl)ethyl]decahydroquinolin-4-ol
Smiles: COc1cc(CCN2CCC(C3C2CCCC3)O)ccc1OC

STK687307
Synonyms: 1-tert-butyl-4-methylpiperidin-3-ol
Smiles: CC1CCN(CC1O)C(C)(C)C

STK783466
Synonyms: methyl5-cyano-4-(2,3-dimethoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1cccc(c1OC)OC)C#N)n1cccc1

STK783467
Synonyms: ethyl5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4-(3,4,5-trimethoxyphenyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1cc(OC)c(c(c1)OC)OC)C#N)n1cccc1

STK783468
Synonyms: ethyl4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1ccc2c(c1)OCO2)C#N)n1cccc1

STK783485
Synonyms: ethyl5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1)OC)OC)C#N)n1cccc1

STK783486
Synonyms: ethyl5-cyano-4-(2,5-dimethoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1cc(OC)ccc1OC)C#N)n1cccc1

STK783489
Synonyms: methyl5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1)OC)O)C#N)n1cccc1

STK783493
Synonyms: 4-(4-fluorophenyl)-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: O=C1CC(c2ccc(cc2)F)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783494
Synonyms: 4-(3-fluorophenyl)-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: O=C1CC(c2cccc(c2)F)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783495
Synonyms: 4-(3-methoxyphenyl)-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: COc1cccc(c1)C1CC(=O)OC2=C1C(=O)c1c(C2=O)cccc1

STK783496
Synonyms: 4-(1,3-benzodioxol-5-yl)-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: O=C1CC(c2ccc3c(c2)OCO3)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783497
Synonyms: 4-(thiophen-3-yl)-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: O=C1CC(c2ccsc2)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783498
Synonyms: 4-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: O=C1CC(c2ccc(cc2)C(F)(F)F)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783500
Synonyms: 4-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: COc1cc(ccc1O)C1CC(=O)OC2=C1C(=O)c1c(C2=O)cccc1

STK783510
Synonyms: 5-oxo-4-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(OC2=C(C1c1cccnc1)C(=O)CCC2)n1cccc1

STK687315
Synonyms: 3-methylphenyl{[4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl}sulfamate
Smiles: Fc1ccc(cc1)c1nc(NC(=O)NS(=O)(=O)Oc2cccc(c2)C)nc(c1)C(F)(F)F

STK687316
Synonyms: 3,3-dimethyl-1-(3,4,5-trimethoxyphenyl)-2-azaspiro[4.5]deca-1,6,9-trien-8-one
Smiles: COc1cc(cc(c1OC)OC)C1=NC(CC21C=CC(=O)C=C2)(C)C

STK783512
Synonyms: 2-(2-chlorophenyl)-N-(4-methoxyphenyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1cccc2c1C(=O)N(C2)c1ccccc1Cl

STK783513
Synonyms: N-(furan-2-ylmethyl)-3-oxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindole-4-carboxamide
Smiles: O=C(c1cccc2c1C(=O)N(C2)CC1CCCO1)NCc1ccco1

STK687318
Synonyms: N-[3-(trifluoromethyl)phenyl]-2,3-dihydrofuro[3,4-b][1,4]dioxine-5-carboxamide
Smiles: O=C(c1occ2c1OCCO2)Nc1cccc(c1)C(F)(F)F

STK783517
Synonyms: methyl4-(thiophen-2-yl)-2-(trifluoromethyl)-2H-pyrido[1,2-a][1,3,5]triazine-2-carboxylate
Smiles: COC(=O)C1(N=c2ccccn2C(=N1)c1cccs1)C(F)(F)F

STK783520
Synonyms: 4-(4-hydroxybenzyl)-5-methyl-1,3-dihydro-2H-imidazole-2-thione
Smiles: Cc1[nH]c(=S)[nH]c1Cc1ccc(cc1)O

STK687319
Synonyms: 1-benzyloctahydro-4H-cyclopenta[b]pyridin-4-one
Smiles: O=C1CCN(C2C1CCC2)Cc1ccccc1

STK687320
Synonyms: 1-phenyl-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)methanamine
Smiles: NC(C12CC3CC(C2)CC(C1)C3)c1ccccc1

STK783521
Synonyms: N-{[2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}benzenesulfonamide
Smiles: O=S(=O)(c1ccccc1)NCC1c2ccccc2CCN1S(=O)(=O)c1ccccc1

STK783524
Synonyms: 2-[1-(4-chlorobenzyl)-1H-indol-3-yl]-2-oxo-N-(pyridin-4-yl)acetamide
Smiles: Clc1ccc(cc1)Cn1cc(c2c1cccc2)C(=O)C(=O)Nc1ccncc1

STK687323
Synonyms: 5-tert-butyl-6a-hydroxy-3a-methylhexahydro-4H-furo[2,3-c]pyrrol-4-one
Smiles: O=C1N(CC2(C1(C)CCO2)O)C(C)(C)C

STK783527
Synonyms: 4,5-dimethoxy-2-(1H-pyrrol-1-yl)benzonitrile
Smiles: COc1cc(c(cc1OC)C#N)n1cccc1

STK783528
Synonyms: 5,6,7,8-tetrahydronaphthalen-2-amine
Smiles: Nc1ccc2c(c1)CCCC2

STK783529
Synonyms: 5-ethyl-4-hydroxy-3-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4,5-dimethyl-1,3-oxazolidin-2-one
Smiles: CCC1(C)OC(=O)N(C1(C)O)CCc1c[nH]c2c1cc(OC)cc2

STK783530
Synonyms: 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile
Smiles: N#Cc1cn[nH]c1NCc1cccnc1

STK783533
Synonyms: 5-methyl-4-(morpholin-4-ylmethyl)thiophene-2-carbaldehyde
Smiles: O=Cc1cc(c(s1)C)CN1CCOCC1

STK783534
Synonyms: 3-hydroxy-3-(pyridin-3-yl)butan-2-one
Smiles: CC(=O)C(c1cccnc1)(O)C

STK783540
Synonyms: 5,7-dimethyl-3-nitropyrazolo[1,5-a]pyrimidin-2(1H)-one
Smiles: Cc1cc(C)n2c(n1)c([N+](=O)[O-])c(=O)[nH]2

STK687331
Synonyms: 6,6'-(4-nitro-1H-pyrazole-3,5-diyl)bispyrazolo[1,5-a]pyrimidine-2-carboxylicacid
Smiles: OC(=O)c1cc2n(n1)cc(cn2)c1n[nH]c(c1[N+](=O)[O-])c1cnc2n(c1)nc(c2)C(=O)O

STK783541
Synonyms: 3-bromo-6-(4-nitro-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidin-2(1H)-one
Smiles: [O-][N+](=O)c1c[nH]nc1c1cnc2n(c1)[nH]c(=O)c2Br

STK687332
Synonyms: 7-(4-chlorophenyl)-3-(pyridin-4-yl)-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Smiles: Clc1ccc(cc1)c1cc(=O)n2c(s1)nnc2c1ccncc1

STK687334
Synonyms: 2'-(1,3-benzodioxol-5-yl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccc3c(c2)OCO3)C(=O)C2C1C1(C(=O)Nc3c1cccc3)N1C2CCC1

STK783546
Synonyms: 2'-(4-fluorophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Fc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cccc2

STK687335
Synonyms: 2'-(3,4-dimethoxyphenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: COc1cc(ccc1OC)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cccc2

STK783547
Synonyms: 2'-(3,4-dimethylphenyl)-5-fluoro-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Fc1ccc2c(c1)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1ccc(c(c1)C)C

STK783548
Synonyms: 5-fluoro-2'-(4-methoxyphenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(F)cc2

STK783549
Synonyms: 5-fluoro-2'-(4-fluorophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Fc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(F)cc2

STK687337
Synonyms: 2,4-dichloro-N-(tetrahydrofuran-2-ylmethyl)-5-[(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)sulfamoyl]benzamide
Smiles: Clc1cc(Cl)c(cc1S(=O)(=O)NCC12CC3CC(C2)CC(C1)C3)C(=O)NCC1CCCO1

STK783551
Synonyms: N-(3'-acetyl-5,7-dimethyl-2-oxo-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4]thiadiazol]-5'-yl)acetamide
Smiles: CC(=O)NC1=NN(C2(S1)C(=O)Nc1c2cc(C)cc1C)C(=O)C

STK687339
Synonyms: 2-[3-(pyridin-4-yl)-1H-pyrazol-5-yl][1,2,4]triazolo[1,5-c]quinazoline
Smiles: n1ccc(cc1)c1n[nH]c(c1)c1nn2c(n1)c1ccccc1nc2

STK687342
Synonyms: 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(3-methylpent-1-yn-3-yl)benzamide
Smiles: CCC(NC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)(C#C)C

STK783557
Synonyms: methyl3-methyl-4-{[3-(1H-tetrazol-1-yl)propanoyl]amino}benzoate
Smiles: COC(=O)c1ccc(c(c1)C)NC(=O)CCn1cnnn1

STK783558
Synonyms: 1,3-diacetyl-9-methyl-2-thioxo-1,2,3,4-tetrahydro-5H-6,1,3-benzoxadiazocin-5-one
Smiles: O=C1CN(C(=O)C)C(=S)N(c2c(O1)ccc(c2)C)C(=O)C

STK783559
Synonyms: 4-(cyclohex-1-en-1-yl)-1,2,3,4-tetrahydro-1,10-phenanthroline
Smiles: C1CCC(=CC1)C1CCNc2c1ccc1c2nccc1

STK687348
Synonyms: N-(3,5-diphenyl-4H-1,2,4-triazol-4-yl)naphthalene-2-sulfonamide
Smiles: O=S(=O)(c1ccc2c(c1)cccc2)Nn1c(nnc1c1ccccc1)c1ccccc1

STK687351
Synonyms: 4-[(4-fluorophenyl)carbonyl]-3-hydroxy-1-{2-[(2-hydroxyethyl)amino]ethyl}-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCNCCN1C(c2ccc(cc2)OC)C(=C(C1=O)O)C(=O)c1ccc(cc1)F

STK783566
Synonyms: 1,3,7-trimethyl-8-(2-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1ccccc1n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK687371
Synonyms: methyl(5,5-dimethyl-4,6-dioxo-2-phenyltetrahydro-2H-pyran-3-yl)acetate
Smiles: COC(=O)CC1C(OC(=O)C(C1=O)(C)C)c1ccccc1

STK783567
Synonyms: 2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Smiles: O=c1c2ccccc2nc2n1nc(s2)c1cccnc1

STK687382
Synonyms: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(5,6,7,8,9,10-hexahydrocycloocta[4,5]thieno[2,3-d]pyrimidin-4-yl)acetamide
Smiles: O=C(Nc1ncnc2c1c1CCCCCCc1s2)CSc1nc(C)cc(n1)C

STK783571
Synonyms: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(6-nitro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetamide
Smiles: O=C(Cn1sc2c(c1=O)ccc(c2)[N+](=O)[O-])Nc1ccc(cc1C(F)(F)F)Cl

STK783575
Synonyms: 4-hydroxy-3-[4-(1H-imidazol-1-yl)butyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one
Smiles: O=C1OC(C(N1CCCCn1cncc1)(C)O)(C)C

STK783576
Synonyms: N-(4-fluorophenyl)-3-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)propanamide
Smiles: O=C(Nc1ccc(cc1)F)CCN1C(=O)OC(C1(C)O)(C)C

STK783577
Synonyms: 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(4-fluorophenyl)propanamide
Smiles: CCC1(C)OC(=O)N(C1(C)O)CCC(=O)Nc1ccc(cc1)F

STK783578
Synonyms: N-(4-fluorophenyl)-3-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]dec-3-yl)propanamide
Smiles: O=C(Nc1ccc(cc1)F)CCN1C(=O)OC2(C1(C)O)CCCCC2

STK783579
Synonyms: 4-hydroxy-4-methyl-3-[(2-methylphenyl)amino]-1-oxa-3-azaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(N1Nc1ccccc1C)(C)O)CCCCC2

STK783580
Synonyms: 2-[(1H-benzotriazol-4-ylamino)methyl]-4,6-diiodophenol
Smiles: Ic1cc(CNc2cccc3c2nn[nH]3)c(c(c1)I)O

STK783582
Synonyms: 7-(4-chlorophenyl)-3-(2-fluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Smiles: Clc1ccc(cc1)c1cc(=O)n2c(s1)nnc2c1ccccc1F

STK783584
Synonyms: 4-amino-N-methyl-5-(phenylcarbonyl)-1,2-oxazole-3-carboxamide
Smiles: CNC(=O)c1noc(c1N)C(=O)c1ccccc1

STK783586
Synonyms: 3-(2-fluorophenyl)-7-(4-methylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Smiles: Cc1ccc(cc1)c1cc(=O)n2c(s1)nnc2c1ccccc1F

STK783590
Synonyms: 4-amino-N-(4-fluorophenyl)-5-(phenylcarbonyl)-1,2-oxazole-3-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1noc(c1N)C(=O)c1ccccc1

STK783593
Synonyms: methyl5-(furan-2-yl)-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-7-carboxylate
Smiles: COC(=O)c1cc(c2ccco2)c2c(n1)n(C)c(=O)[nH]c2=O

STK687392
Synonyms: 4-acetyl-3-hydroxy-1-[2-(1H-imidazol-4-yl)ethyl]-5-(thiophen-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1cccs1)CCc1c[nH]cn1

STK783596
Synonyms: 5-(4-fluorophenyl)-4-[(4-fluorophenyl)carbonyl]-3-hydroxy-1-[2-(1H-imidazol-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)C1N(CCc2c[nH]cn2)C(=O)C(=C1C(=O)c1ccc(cc1)F)O

STK783597
Synonyms: 5-(3-fluorophenyl)-4-[(4-fluorophenyl)carbonyl]-3-hydroxy-1-[2-(1H-imidazol-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1cccc(c1)C1N(CCc2c[nH]cn2)C(=O)C(=C1C(=O)c1ccc(cc1)F)O

STK687394
Synonyms: 3-hydroxy-1-{3-[(2-hydroxyethyl)amino]propyl}-5-phenyl-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCNCCCN1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1ccccc1

STK687395
Synonyms: 1-(4-chlorobenzyl)-1H-indole-3-carboxylicacid
Smiles: Clc1ccc(cc1)Cn1cc(c2c1cccc2)C(=O)O

STK687396
Synonyms: 5-(3,4-diethoxybenzyl)-1H-tetrazole
Smiles: CCOc1cc(ccc1OCC)Cc1nnn[nH]1

STK783599
Synonyms: N-[4-(dimethylamino)-6-({5-[4-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}methyl)-1,3,5-triazin-2-yl]acetamide
Smiles: CC(=O)Nc1nc(Cn2nnc(n2)c2ccc(cc2)C(F)(F)F)nc(n1)N(C)C

STK687397
Synonyms: [3-(ethoxycarbonyl)-5-methoxy-2-methyl-1H-indol-1-yl]aceticacid
Smiles: CCOC(=O)c1c(C)n(c2c1cc(OC)cc2)CC(=O)O

STK687398
Synonyms: 4-(cyclohexylamino)tricyclo[3.3.1.1~3,7~]decan-1-ol
Smiles: OC12CC3CC(C2)C(C(C1)C3)NC1CCCCC1

STK783603
Synonyms: 1,4,5,7-tetramethyl-6-phenyl-6H-pyrrolo[3,4-d]pyridazine
Smiles: Cc1nnc(c2c1c(C)n(c2C)c1ccccc1)C

STK783604
Synonyms: 2-chloro-5-(1,4,5,7-tetramethyl-6H-pyrrolo[3,4-d]pyridazin-6-yl)aniline
Smiles: Clc1ccc(cc1N)n1c(C)c2c(c1C)c(C)nnc2C

STK687401
Synonyms: 6,8-dichloro-3-[(4-methylpiperazin-1-yl)carbonyl]-2H-chromen-2-one
Smiles: CN1CCN(CC1)C(=O)c1cc2cc(Cl)cc(c2oc1=O)Cl

STK783608
Synonyms: ethyl3-{[(6-chloro-2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1cc2cc(Cl)ccc2oc1=O

STK783611
Synonyms: 1-[(5-fluoro-2-methoxyphenyl)sulfonyl]-4-methyl-2-phenyl-1H-imidazole
Smiles: COc1ccc(cc1S(=O)(=O)n1cc(nc1c1ccccc1)C)F

STK783612
Synonyms: 4-[3-(2,3-dihydro-1H-inden-5-yloxy)-2-hydroxypropyl]-N,N-dimethylpiperazine-1-sulfonamide
Smiles: OC(CN1CCN(CC1)S(=O)(=O)N(C)C)COc1ccc2c(c1)CCC2

STK783619
Synonyms: 6-chloro-N-{1-[4-(1H-imidazol-1-yl)phenyl]ethyl}-2-oxo-2H-chromene-3-carboxamide
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)C(=O)NC(c1ccc(cc1)n1cncc1)C

STK783622
Synonyms: N-{1-[4-(1H-imidazol-1-yl)phenyl]ethyl}-2-methyl-5-nitrobenzenesulfonamide
Smiles: CC(c1ccc(cc1)n1cncc1)NS(=O)(=O)c1cc(ccc1C)[N+](=O)[O-]

STK783626
Synonyms: 1-[4-(morpholin-4-ylsulfonyl)piperazin-1-yl]-3-(1H-1,2,4-triazol-1-yl)propan-1-one
Smiles: O=C(N1CCN(CC1)S(=O)(=O)N1CCOCC1)CCn1ncnc1

STK783630
Synonyms: N-(1H-indazol-7-yl)-2,5-dimethoxy-4-methylbenzenesulfonamide
Smiles: COc1cc(C)c(cc1S(=O)(=O)Nc1cccc2c1[nH]nc2)OC

STK783631
Synonyms: 2,5-diethoxy-N-(1H-indazol-7-yl)-4-methylbenzenesulfonamide
Smiles: CCOc1cc(C)c(cc1S(=O)(=O)Nc1cccc2c1[nH]nc2)OCC

STK783632
Synonyms: 3-tert-butyl-N-(1H-indazol-7-yl)-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1C(C)(C)C)S(=O)(=O)Nc1cccc2c1[nH]nc2

STK687404
Synonyms: 3-benzyl-5-[(4-fluorobenzyl)sulfanyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Smiles: Fc1ccc(cc1)CSc1[nH]c(=O)c2c(n1)n(nn2)Cc1ccccc1

STK687408
Synonyms: methyl2-[(benzylamino)methyl]-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)furan-3-carboxylate
Smiles: COC(=O)c1cc(oc1CNCc1ccccc1)C12CC3CC(C2)CC(C1)C3

STK687410
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-2-(trifluoromethyl)-1H-benzimidazol-7-amine
Smiles: FC(c1nc2c([nH]1)c(ccc2)NCc1ccc2c(c1)OCO2)(F)F

STK783634
Synonyms: N-(4-fluorobenzyl)-2-(trifluoromethyl)-1H-benzimidazol-7-amine
Smiles: Fc1ccc(cc1)CNc1cccc2c1[nH]c(n2)C(F)(F)F

STK687412
Synonyms: 5-hydroxy-1-phenyl-5-(trifluoromethyl)-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H)-trione
Smiles: O=C1Nc2c(C1(O)C(F)(F)F)c(=O)[nH]c(=O)n2c1ccccc1

STK783637
Synonyms: 5,5-dimethyl-2,6-dioxo-4-phenylpiperidine-3-carbonitrile
Smiles: N#CC1C(=O)NC(=O)C(C1c1ccccc1)(C)C

STK687413
Synonyms: 1-cyano-2-methyl-3-phenyl-2-(phenylcarbonyl)cyclopropanecarboxamide
Smiles: N#CC1(C(=O)N)C(C1(C)C(=O)c1ccccc1)c1ccccc1

STK783638
Synonyms: 1-cyano-2-methyl-N-(3-methylphenyl)-3-phenyl-2-(phenylcarbonyl)cyclopropanecarboxamide
Smiles: N#CC1(C(=O)Nc2cccc(c2)C)C(C1(C)C(=O)c1ccccc1)c1ccccc1

STK783639
Synonyms: 7-(4-methylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Smiles: Cc1ccc(cc1)c1cc(=O)n2c(s1)nnc2

STK783644
Synonyms: methyl4-[(carbamoylamino)methyl]-5-ethylfuran-2-carboxylate
Smiles: COC(=O)c1cc(c(o1)CC)CNC(=O)N

STK687416
Synonyms: 1-(3-O-butanoyl-2-deoxypentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione
Smiles: CCCC(=O)OC1CC(OC1CO)n1cc(C)c(=O)[nH]c1=O

STK687417
Synonyms: 4-[(2-fluoro-4,5-dimethoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine
Smiles: COc1cc(c(cc1OC)F)S(=O)(=O)N1CCOc2c1cccc2

STK687419
Synonyms: 2-[(1E)-1-hydrazinylideneethyl]-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-amine
Smiles: COCc1cc(C)nc2c1c(N)c(s2)/C(=N/N)/C

STK687420
Synonyms: N-{4-[1-benzyl-5-(methoxymethyl)-7-methyl-4-oxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-2-yl]phenyl}acetamide
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2Cc1ccccc1)c1ccc(cc1)NC(=O)C

STK783646
Synonyms: 2-[4-(dimethylamino)phenyl]-1-(4-fluorophenyl)-5-(methoxymethyl)-7-methyl-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2c1ccc(cc1)F)c1ccc(cc1)N(C)C

STK687421
Synonyms: 4-(methoxymethyl)-6-methyl-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridine-3-carboxamide
Smiles: COCc1cc(C)nc(c1C(=O)N)NC1CC(C)(C)NC(C1)(C)C

STK687423
Synonyms: 4-[5-(4,4-diethyl-1,4-dihydro-2H-3,1-benzoxazin-2-yl)furan-2-yl]benzoicacid
Smiles: CCC1(CC)OC(Nc2c1cccc2)c1ccc(o1)c1ccc(cc1)C(=O)O

STK687424
Synonyms: ethyl({(1Z)-1-[(5-cyano-2,4-dimethyl-1H-pyrrol-3-yl)methylidene]-6-methyl-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl}sulfanyl)acetate
Smiles: CCOC(=O)CSc1nc(C)cc2c1C(=O)O/C/2=C\c1c(C)[nH]c(c1C)C#N

STK687425
Synonyms: 2-{(E)-[(2-amino-4,6-dimethylthieno[2,3-b]pyridin-3-yl)imino]methyl}phenol
Smiles: Cc1cc(C)c2c(n1)sc(c2/N=C/c1ccccc1O)N

STK687430
Synonyms: 12-benzyl-4-(methoxymethyl)-2-methyl-11b,12-dihydropyrido[2',3':4,5]pyrimido[2,1-a]isoindole-5,7-dione
Smiles: COCc1cc(C)nc2c1C(=O)N1C(=O)c3c(C1N2Cc1ccccc1)cccc3

STK687431
Synonyms: 2-{[3-(hydrazinylcarbonyl)-4-(hydroxymethyl)-6-methylpyridin-2-yl]sulfanyl}-N-(quinolin-8-yl)acetamide
Smiles: NNC(=O)c1c(SCC(=O)Nc2cccc3c2nccc3)nc(cc1CO)C

STK783652
Synonyms: 4-(4,4-diphenyl-1,4-dihydro-2H-3,1-benzoxazin-2-yl)-3,5-dimethyl-1H-pyrrole-2-carbonitrile
Smiles: N#Cc1[nH]c(c(c1C)C1Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1)C

STK687433
Synonyms: 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carbonitrile
Smiles: CCCOc1nc(C)cc(c1C#N)COC

STK783653
Synonyms: 5-chloro-3-cyano-N-cyclopropyl-4,6-dimethylpyridine-2-sulfonamide
Smiles: N#Cc1c(C)c(Cl)c(nc1S(=O)(=O)NC1CC1)C

STK687434
Synonyms: 3-amino-N-(6-cyano-1,3-benzodioxol-5-yl)-4,5,6-trimethylthieno[2,3-b]pyridine-2-carboxamide
Smiles: N#Cc1cc2OCOc2cc1NC(=O)c1sc2c(c1N)c(C)c(c(n2)C)C

STK783659
Synonyms: ethyl4-amino-3-cyano-10-(4-methoxyphenyl)-8-methylpyrido[2',3':3,4]pyrazolo[5,1-c][1,2,4]triazine-9-carboxylate
Smiles: CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)OC)c1nnc(c(n1n2)N)C#N

STK783662
Synonyms: 8-[2-(3,4-dimethoxyphenyl)ethyl]-1,3,6-trimethyl-7-(4-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(ccc1OC)CCn1c2nc3c(n2c(c1c1ccc(cc1)C)C)c(=O)n(c(=O)n3C)C

STK783666
Synonyms: 6-(3,5-dimethylphenyl)-1-methyl-4-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: Cc1cc(C)cc(c1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccccc1

STK783667
Synonyms: 6-(3,5-dichlorophenyl)-1-methyl-4-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: Clc1cc(Cl)cc(c1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccccc1

STK783668
Synonyms: 6-(1,1-dioxidotetrahydrothiophen-3-yl)-4-(4-methoxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: COc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)C1CCS(=O)(=O)C1)C

STK687441
Synonyms: 4-(4-hydroxy-3-methoxyphenyl)-1-methyl-6-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: COc1cc(ccc1O)C1NC(=O)N(C2=C1C(=O)N(C2)c1ccccc1)C

STK783669
Synonyms: 6-(3-chlorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: COc1cc(ccc1O)C1NC(=O)N(C2=C1C(=O)N(C2)c1cccc(c1)Cl)C

STK783676
Synonyms: 8-(2-methoxyethyl)-1,3,6-trimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c2nc3c(n2c(c1c1ccccc1)C)c(=O)n(c(=O)n3C)C

STK783683
Synonyms: 1-(1,1-dioxidotetrahydrothiophen-3-yl)-7,9-dimethyl-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n1CC(=NN(c1n2)C1CCS(=O)(=O)C1)c1ccccc1

STK783687
Synonyms: 6-(4-chlorophenyl)-1-methyl-4-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: Clc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccccc1

STK783689
Synonyms: 6-(1,1-dioxidotetrahydrothiophen-3-yl)-1-methyl-4-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: O=C1NC(c2ccccc2)C2=C(N1C)CN(C2=O)C1CCS(=O)(=O)C1

STK783690
Synonyms: 6-(4-chlorophenyl)-4-(4-methoxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: COc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1ccc(cc1)Cl)C

STK783693
Synonyms: 4-(4-hydroxyphenyl)-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: O=C1CC(c2ccc(cc2)O)c2c(O1)c1ccccc1[nH]c2=O

STK687444
Synonyms: 1'-(3-chloro-4-fluorophenyl)-2,5'-dioxo-1-(prop-2-yn-1-yl)-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: C#CCN1c2ccccc2C2(C1=O)C(=C(n1cccc1)N(C1=C2C(=O)CCC1)c1ccc(c(c1)Cl)F)C#N

STK783706
Synonyms: 1-cyclopentyl-3,4-dimethyl-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: Cc1nn(c2c1c(C)cc(=O)[nH]2)C1CCCC1

STK783707
Synonyms: 1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-methyl-4-phenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: O=C1CSC(c2c(N1)n(nc2C)C1CCOC(C1)(C)C)c1ccccc1

STK687446
Synonyms: 1-benzyl-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridine
Smiles: Cc1cc(C)c2c(n1)n(Cc1ccccc1)nc2C

STK783711
Synonyms: N-[4-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3-thiazol-2-yl]acetamide
Smiles: CC(=O)Nc1scc(n1)C1COc2c(O1)cccc2

STK783713
Synonyms: 7-methyl-2-oxo-2,3-dihydro[1,3]thiazolo[4,5-b]pyridin-5-ylacetate
Smiles: CC(=O)Oc1cc(C)c2c(n1)[nH]c(=O)s2

STK783717
Synonyms: 1-(4-fluorophenyl)-3-[3-(imidazo[1,2-a]pyrimidin-2-yl)phenyl]urea
Smiles: O=C(Nc1ccc(cc1)F)Nc1cccc(c1)c1cn2c(n1)nccc2

STK783719
Synonyms: N-(4-chlorophenyl)-6-(pyrrolidin-1-yl)pyridazin-3-amine
Smiles: Clc1ccc(cc1)Nc1ccc(nn1)N1CCCC1

STK783721
Synonyms: N-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,2,5-oxadiazol-3-yl]-4-methylbenzamide
Smiles: O=C(c1ccc(cc1)C)Nc1nonc1N1C(=O)c2c(C1=O)cccc2

STK783725
Synonyms: 6-(3,4,5-trimethoxyphenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)Nc2c1c(=O)[nH]c1n2ncn1

STK783729
Synonyms: ethyl5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4-(2,3,4-trimethoxyphenyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1OC)OC)OC)C#N)n1cccc1

STK783730
Synonyms: methyl5-cyano-4-(4-hydroxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1ccc(cc1)O)C#N)n1cccc1

STK783733
Synonyms: 4-(2,3-dimethoxyphenyl)-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: COc1cccc(c1OC)C1CC(=O)OC2=C1C(=O)c1c(C2=O)cccc1

STK783735
Synonyms: 4-[4-(propan-2-yl)phenyl]-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: O=C1CC(c2ccc(cc2)C(C)C)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783737
Synonyms: 4-[4-(benzyloxy)phenyl]-6-methyl-3,4-dihydropyrido[3',2':5,6]pyrimido[1,2-a]benzimidazole-2,5(1H,6H)-dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccccc2)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783738
Synonyms: 4-{4-[(2-fluorobenzyl)oxy]phenyl}-6-methyl-3,4-dihydropyrido[3',2':5,6]pyrimido[1,2-a]benzimidazole-2,5(1H,6H)-dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccccc2F)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783739
Synonyms: 6-methyl-4-{4-[(3-methylbenzyl)oxy]phenyl}-3,4-dihydropyrido[3',2':5,6]pyrimido[1,2-a]benzimidazole-2,5(1H,6H)-dione
Smiles: O=C1CC(c2ccc(cc2)OCc2cccc(c2)C)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783740
Synonyms: 4-{4-[(3-chlorobenzyl)oxy]phenyl}-6-methyl-3,4-dihydropyrido[3',2':5,6]pyrimido[1,2-a]benzimidazole-2,5(1H,6H)-dione
Smiles: O=C1CC(c2ccc(cc2)OCc2cccc(c2)Cl)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783749
Synonyms: 1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-4-phenyl-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=c1[nH]nc(c(c1)NN1C(=O)CC(C2=C1CCCC2=O)c1ccccc1)c1ccccc1

STK783751
Synonyms: 4-(4-fluorophenyl)-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Fc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)Nc1cc(=O)[nH]nc1c1ccccc1

STK783762
Synonyms: 2-[(2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]ethanol
Smiles: [O-][N+](=O)c1nc([nH]c1SCCO)C

STK687456
Synonyms: 8a-phenylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Smiles: O=C1CNC(=O)C2(N1CCC2)c1ccccc1

STK783769
Synonyms: 2-(1H-indol-3-yl)-5,7-diphenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
Smiles: OC1C2(CN3CC1(CN(C2)C3c1c[nH]c2c1cccc2)c1ccccc1)c1ccccc1

STK783775
Synonyms: (cyanomethyl)[4-(morpholin-4-yl)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]cyanamide
Smiles: N#CCN(c1nc(NC(C)C)nc(n1)N1CCOCC1)C#N

STK783777
Synonyms: 2-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1C2CCCCC2C(=O)N1c1nonc1n1cccc1

STK687458
Synonyms: 3-(2,4-dichlorophenyl)-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoicacid
Smiles: OC(=O)CC(N1C(=O)c2c(C1=O)cccc2)c1ccc(cc1Cl)Cl

STK783780
Synonyms: (5Z)-3-[2-(1H-benzimidazol-2-yl)ethyl]-5-(1,3-benzodioxol-5-ylmethylidene)-2-(3-nitrophenyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/N=C(N1CCc1nc2c([nH]1)cccc2)c1cccc(c1)[N+](=O)[O-]

STK783784
Synonyms: (5Z)-3-[2-(1H-benzimidazol-2-yl)ethyl]-2-(5-bromofuran-2-yl)-5-(4-methoxybenzylidene)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1)/C=C/1\N=C(N(C1=O)CCc1nc2c([nH]1)cccc2)c1ccc(o1)Br

STK687465
Synonyms: 2-[4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-1,2,5-oxadiazol-3-yl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C1C2CCCCC2C(=O)N1c1nonc1N1C(=O)c2c(C1=O)cccc2

STK783788
Synonyms: N-(5-chloropyridin-2-yl)-2-{[5-(4-hydroxybenzyl)-4-methyl-1H-imidazol-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cn1)Cl)CSc1[nH]c(c(n1)C)Cc1ccc(cc1)O

STK783792
Synonyms: 2-(5-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-2H-tetrazol-2-yl)-N-(3-methylpent-1-yn-3-yl)acetamide
Smiles: CCC(NC(=O)Cn1nnc(n1)c1ccc(cc1)OCc1c(F)cccc1Cl)(C#C)C

STK783794
Synonyms: N-(4-methoxyphenyl)-6-methyl[1,2,4]triazolo[4,3-b]pyridazin-8-amine
Smiles: COc1ccc(cc1)Nc1cc(C)nn2c1nnc2

STK687468
Synonyms: 6-methyl-8-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
Smiles: CN1CCN(CC1)c1cc(C)nn2c1nnc2

STK687469
Synonyms: ethyl4-{[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)Cn1nc(c(c1C)Cl)C

STK783807
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-(1-phenylethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NC(c1ccccc1)C

STK783808
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)Nc1nnc(s1)CCc1ccccc1

STK783830
Synonyms: N-(3-chlorophenyl)-4-(4-methylphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)Cl)c1ccccc1

STK687532
Synonyms: ethyl2-{[({2-[2-(3-acetyl-6-methyl-4-oxo-4H-pyran-2-yl)hydrazinyl]-2-oxoethyl}sulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSCC(=O)NNc2oc(C)cc(=O)c2C(=O)C)sc2c1CCCC2

STK687533
Synonyms: 6-(methylsulfanyl)-N,N'-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
Smiles: CSc1nc(NC(C)C)nc(n1)NC(C)C

STK783850
Synonyms: 3-benzyl-1-[2-(4-chlorophenoxy)ethyl]-5-methylpyrimidine-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1)OCCn1cc(C)c(=O)n(c1=O)Cc1ccccc1

STK783860
Synonyms: 1,3-dimethyl-7-[1-(4-methylphenyl)-1-oxopropan-2-yl]-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)C(=O)C(n1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1)C

STK783869
Synonyms: 1-(1,1-dioxidotetrahydrothiophen-3-yl)-4,7,9-trimethyl-3-(4-methylphenyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: Cc1ccc(cc1)C1=NN(C2CCS(=O)(=O)C2)c2n(C1C)c1c(=O)n(C)c(=O)n(c1n2)C

STK783872
Synonyms: ethyl4-[4-(4-methoxyphenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccc(cc1)OC

STK687557
Synonyms: 8-(2-fluorobenzyl)-5-(2-fluorophenyl)-7-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile
Smiles: N#Cc1c(=O)n(Cc2ccccc2F)c2n(c1c1ccccc1F)cnn2

STK687558
Synonyms: 8-amino-6-tert-butyl-3-(4-chlorophenyl)[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Smiles: Clc1ccc(cc1)c1nnc2n1nc(c(=O)n2N)C(C)(C)C

STK687560
Synonyms: 2'-(1,3-benzodioxol-5-yl)-7-(trifluoromethyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccc3c(c2)OCO3)C(=O)C2C1C1CCCN1C12C(=O)Nc2c1cccc2C(F)(F)F

STK783884
Synonyms: 1,1'-[6-(thiophen-2-yl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]diethanone
Smiles: CC(=O)c1sc2nncn2n(c1c1cccs1)C(=O)C

STK783886
Synonyms: ethyl1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-oxidopyridin-3-yl)-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccc[n+](c1)[O-])c1nonc1N

STK783891
Synonyms: 2'-amino-7'-methyl-2,5'-dioxo-1'-(pyridin-3-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(N)N(c2cccnc2)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CC(C2)C

STK687569
Synonyms: 4-(2-fluorophenyl)-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=c1[nH]nc(c(c1)NN1C(=O)CC(C2=C1CCCC2=O)c1ccccc1F)c1ccccc1

STK687570
Synonyms: ethyl5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=CNC2=C(C1c1cccs1)C(=O)CCC2

STK687573
Synonyms: 7-(morpholin-4-ylsulfonyl)-5H-[1,3]thiazolo[3,2-a]quinazolin-5-one
Smiles: O=c1nc2sccn2c2c1cc(cc2)S(=O)(=O)N1CCOCC1

STK783893
Synonyms: N-(3-{methyl[(2-oxo-1,3-benzoxazol-3(2H)-yl)acetyl]amino}propyl)-N'-(4-methylphenyl)ethanediamide
Smiles: Cc1ccc(cc1)NC(=O)C(=O)NCCCN(C(=O)Cn1c(=O)oc2c1cccc2)C

STK687574
Synonyms: 9-chloro-8-(piperidin-1-ylsulfonyl)-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: Clc1cc2c(cc1S(=O)(=O)N1CCCCC1)c(=O)nc1n2cccc1

STK783895
Synonyms: 9-chloro-8-[(4-methylpiperidin-1-yl)sulfonyl]-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: CC1CCN(CC1)S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cccc3

STK687576
Synonyms: 8-(piperidin-1-ylsulfonyl)-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: O=c1nc2ccccn2c2c1cc(cc2)S(=O)(=O)N1CCCCC1

STK783896
Synonyms: 8-[(3-methylpiperidin-1-yl)sulfonyl]-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: CC1CCCN(C1)S(=O)(=O)c1ccc2c(c1)c(=O)nc1n2cccc1

STK687577
Synonyms: 8-(morpholin-4-ylsulfonyl)-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: O=c1nc2ccccn2c2c1cc(cc2)S(=O)(=O)N1CCOCC1

STK783898
Synonyms: 2-chloro-8-(morpholin-4-ylsulfonyl)-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: Clc1ccc2n(c1)c1ccc(cc1c(=O)n2)S(=O)(=O)N1CCOCC1

STK687581
Synonyms: methylN-propan-2-yl-N-prop-2-yn-1-yl-beta-alaninate
Smiles: COC(=O)CCN(C(C)C)CC#C

STK783902
Synonyms: 4-(5-fluoro-1-methyl-1H-indol-3-yl)-6-methyl-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: O=C1CC(c2c(O1)c1ccccc1n(c2=O)C)c1cn(c2c1cc(F)cc2)C

STK783912
Synonyms: 4-(4-fluorophenyl)-7,7-dimethyl-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Fc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)Nc1cc(=O)[nH]nc1c1ccccc1

STK783914
Synonyms: 4-(4-hydroxyphenyl)-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Oc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)Nc1cc(=O)[nH]nc1c1ccccc1

STK783916
Synonyms: 4-(1H-tetrazol-1-yl)-N-[2-(trifluoromethyl)-1H-benzimidazol-4-yl]benzamide
Smiles: O=C(c1ccc(cc1)n1cnnn1)Nc1cccc2c1nc([nH]2)C(F)(F)F

STK783918
Synonyms: 4-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-benzo[g]chromene-2,5,10-trione
Smiles: COc1ccc(cc1OC)C1CC(=O)OC2=C1C(=O)c1c(C2=O)cccc1

STK783925
Synonyms: 9-chloro-N,N-diethyl-6-oxo-6H-pyrido[1,2-a]quinazoline-8-sulfonamide
Smiles: CCN(S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cccc3)CC

STK687586
Synonyms: 9-chloro-8-[(2-methylpiperidin-1-yl)sulfonyl]-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: CC1CCCCN1S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cccc3

STK783926
Synonyms: 9-chloro-N-(4-methoxyphenyl)-N-methyl-6-oxo-6H-pyrido[1,2-a]quinazoline-8-sulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cccc3)C

STK783929
Synonyms: N-(4-methoxyphenyl)-N-methyl-6-oxo-6H-pyrido[1,2-a]quinazoline-8-sulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc2c(c1)c(=O)nc1n2cccc1)C

STK783948
Synonyms: 2-methoxyethyl1-(2-fluorobenzyl)-5-hydroxy-2-methyl-1H-benzo[g]indole-3-carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(O)c1c2cccc1)Cc1ccccc1F

STK783951
Synonyms: 1-(4-tert-butylphenyl)-3-{[4-(pyridin-4-ylcarbonyl)phenyl]amino}propan-1-one
Smiles: O=C(c1ccc(cc1)C(C)(C)C)CCNc1ccc(cc1)C(=O)c1ccncc1

STK783952
Synonyms: 1-(4-tert-butylphenyl)-3-(4-ethylphenyl)-3-[(3-fluorophenyl)amino]propan-1-one
Smiles: CCc1ccc(cc1)C(CC(=O)c1ccc(cc1)C(C)(C)C)Nc1cccc(c1)F

STK783954
Synonyms: 1-(4-tert-butylphenyl)-3-(4-ethoxyphenyl)-3-[(4-fluorophenyl)amino]propan-1-one
Smiles: CCOc1ccc(cc1)C(CC(=O)c1ccc(cc1)C(C)(C)C)Nc1ccc(cc1)F

STK783956
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCCCn1ccnc1

STK687596
Synonyms: N-[2-(dimethylamino)ethyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: CN(CCNC(=O)c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])C

STK783958
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-2-(4-fluorophenyl)acetamide
Smiles: O=C(Cc1ccc(cc1)F)NCc1nc2c([nH]1)cccc2

STK783959
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1nc2c([nH]1)cccc2

STK783961
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(4-fluorophenyl)acetamide
Smiles: O=C(Cc1ccc(cc1)F)NCCc1nc2c([nH]1)cccc2

STK783962
Synonyms: 3-[(phenylsulfonyl)methyl]-N-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)ethyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)CS(=O)(=O)c1ccccc1)NCCOC12CC3CC(C2)CC(C1)C3

STK783966
Synonyms: 1H-1,2,4-triazol-1-ylmethanol
Smiles: OCn1cncn1

STK783967
Synonyms: 2-methyl-7-(morpholin-4-ylsulfonyl)-9-nitro-5H-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one
Smiles: Cc1nn2c(s1)nc(=O)c1c2c(cc(c1)S(=O)(=O)N1CCOCC1)[N+](=O)[O-]

STK783968
Synonyms: N-(2-fluorophenyl)-2-imino-4-oxo-1,3-thiazinane-6-carboxamide
Smiles: O=C1NC(=N)SC(C1)C(=O)Nc1ccccc1F

STK783973
Synonyms: N,N'-pyridine-2,6-diyldiacetamide
Smiles: CC(=O)Nc1cccc(n1)NC(=O)C

STK783978
Synonyms: (8R,8aR)-6-amino-8-(2,3-dimethoxyphenyl)-8,8a-dihydro-1H-isothiochromene-5,7,7(3H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCSC2)c1cccc(c1OC)OC)(C#N)C#N

STK783982
Synonyms: 4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-hydroxybutanamide
Smiles: ONC(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK783984
Synonyms: 2-methyl-4-[5-methyl-4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-N-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CC1=C(C(=O)Nc2ccccc2)C(C2=C(N1)CCCC2=O)c1sc(c(c1)CN1CCOCC1)C

STK783985
Synonyms: 4-[4-acetyl-5-methyl-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenylacetate
Smiles: CC(=O)N1N=C(OC1(C)C12CC3CC(C2)CC(C1)C3)c1ccc(cc1)OC(=O)C

STK783989
Synonyms: (1S,2S,5R)-2-{3-[(3,4-dimethylphenoxy)methyl]-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nc(n(c1=S)c1ccccc1)COc1ccc(c(c1)C)C

STK783990
Synonyms: 3-(1H-tetrazol-1-yl)-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]propanamide
Smiles: O=C(Nc1nc2c(s1)cc(cc2)OC(F)(F)F)CCn1cnnn1

STK783991
Synonyms: 3,5-bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine
Smiles: Nc1cccc(c1)c1nnc(n1N)c1cccc(c1)N

STK783994
Synonyms: N-({4-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}carbamoyl)benzamide
Smiles: O=C(NC(=O)c1ccccc1)Nc1ccc(cc1)n1nc(cc1C(F)(F)F)c1ccccc1

STK784008
Synonyms: 2-methoxy-N-[2-(pyridin-4-yl)ethyl]benzamide
Smiles: COc1ccccc1C(=O)NCCc1ccncc1

STK784012
Synonyms: methyl3-(acetylamino)-5-fluoro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C)cc(cc2)F

STK784013
Synonyms: N-(2-amino-4-ethoxyphenyl)-2-hydroxypropanamide
Smiles: CCOc1ccc(c(c1)N)NC(=O)C(O)C

STK687613
Synonyms: ethyl2-oxo-1,1',2,2',5',6',7',7a'-octahydrospiro[indole-3,3'-pyrrolizine]-1'-carboxylate
Smiles: CCOC(=O)C1CC2(N3C1CCC3)C(=O)Nc1c2cccc1

STK687614
Synonyms: octahydro-4H-cyclopenta[b]pyridin-4-one
Smiles: O=C1CCNC2C1CCC2

STK687616
Synonyms: 1,2,5-oxadiazole-3,4-dicarbonitrile
Smiles: N#Cc1nonc1C#N

STK784021
Synonyms: 4-amino-2-oxo-1,2-dihydropyrimidine-5-carbonitrile
Smiles: Nc1nc(=O)[nH]cc1C#N

STK784024
Synonyms: 1-[3-(furan-2-yl)-3-hydroxyprop-1-yn-1-yl]cyclohexanol
Smiles: OC(c1ccco1)C#CC1(O)CCCCC1

STK784025
Synonyms: 4,6-dichloro-1H-indole-2,3-dione
Smiles: Clc1cc2NC(=O)C(=O)c2c(c1)Cl

STK784026
Synonyms: ethyl4-hydroxyquinazoline-2-carboxylate
Smiles: CCOC(=O)c1nc(O)c2c(n1)cccc2

STK687619
Synonyms: 3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)propanoicacid
Smiles: OC(=O)CCc1cn2c(n1)SCC2

STK784027
Synonyms: 4,6-dimethoxy-1H-indole
Smiles: COc1cc(OC)c2c(c1)[nH]cc2

STK687620
Synonyms: 4,6-dimethoxy-1H-indole-2-carboxylicacid
Smiles: COc1cc(OC)cc2c1cc([nH]2)C(=O)O

STK784028
Synonyms: 5,6,7-trimethoxy-1H-indole-2-carboxylicacid
Smiles: COc1cc2cc([nH]c2c(c1OC)OC)C(=O)O

STK687621
Synonyms: 3-formyl-5,6-dimethoxy-1H-indole-2-carboxylicacid
Smiles: COc1cc2[nH]c(c(c2cc1OC)C=O)C(=O)O

STK687622
Synonyms: 2-amino-4,6-dichlorobenzoicacid
Smiles: Clc1cc(N)c(c(c1)Cl)C(=O)O

STK784029
Synonyms: 1-acetyl-4,6-dichloro-1H-indole-2,3-dione
Smiles: Clc1cc(Cl)c2c(c1)N(C(=O)C)C(=O)C2=O

STK687623
Synonyms: 5,7-dichloro-2-methylquinoline-4-carboxylicacid
Smiles: Clc1cc(Cl)c2c(c1)nc(cc2C(=O)O)C

STK687625
Synonyms: 1H-1,2,3-triazol-5-ylmethanol
Smiles: OCc1cnn[nH]1

STK784032
Synonyms: 4-amino-N-phenyl-5-(phenylcarbonyl)-1,2-oxazole-3-carboxamide
Smiles: O=C(c1noc(c1N)C(=O)c1ccccc1)Nc1ccccc1

STK784043
Synonyms: methyl4-({[4-(4-nitro-1H-pyrazol-1-yl)butanoyl]amino}methyl)benzoate
Smiles: COC(=O)c1ccc(cc1)CNC(=O)CCCn1ncc(c1)[N+](=O)[O-]

STK784044
Synonyms: 4-{4-[(4-fluorobenzyl)oxy]phenyl}-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccc(cc2)F)c2c(O1)c1ccccc1[nH]c2=O

STK784045
Synonyms: 4-(3-fluorophenyl)-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Fc1cccc(c1)C1CC(=O)N(C2=C1C(=O)CCC2)Nc1cc(=O)[nH]nc1c1ccccc1

STK687631
Synonyms: 3-(1-hydroxycyclohexyl)prop-2-ynoicacid
Smiles: OC(=O)C#CC1(O)CCCCC1

STK687632
Synonyms: 2-methoxy-4,6-dinitrobenzoicacid
Smiles: COc1cc(cc(c1C(=O)O)[N+](=O)[O-])[N+](=O)[O-]

STK784046
Synonyms: methyl[1-(4-chlorobenzyl)-1H-indol-3-yl](oxo)acetate
Smiles: COC(=O)C(=O)c1cn(c2c1cccc2)Cc1ccc(cc1)Cl

STK687634
Synonyms: 3-(octylsulfinyl)propan-1-ol
Smiles: CCCCCCCCS(=O)CCCO

STK687635
Synonyms: 4-(octylsulfonyl)butan-1-ol
Smiles: CCCCCCCCS(=O)(=O)CCCCO

STK687636
Synonyms: 4-(octylsulfinyl)butan-1-ol
Smiles: CCCCCCCCS(=O)CCCCO

STK687637
Synonyms: 3-(octylsulfonyl)propan-1-ol
Smiles: CCCCCCCCS(=O)(=O)CCCO

STK784048
Synonyms: 1-(ethylsulfonyl)-2-{[2-(ethylsulfonyl)ethyl]sulfanyl}ethane
Smiles: CCS(=O)(=O)CCSCCS(=O)(=O)CC

STK687638
Synonyms: (dodecylsulfanyl)aceticacid
Smiles: CCCCCCCCCCCCSCC(=O)O

STK687639
Synonyms: 2-(octylsulfinyl)ethanol
Smiles: CCCCCCCCS(=O)CCO

STK687640
Synonyms: 3-(dodecylsulfinyl)propanoicacid
Smiles: CCCCCCCCCCCCS(=O)CCC(=O)O

STK784049
Synonyms: 2-(hexylsulfonyl)ethanol
Smiles: CCCCCCS(=O)(=O)CCO

STK784052
Synonyms: 1-(2,2-diphenylethenyl)-2-nitrobenzene
Smiles: [O-][N+](=O)c1ccccc1/C=C(\c1ccccc1)/c1ccccc1

STK687642
Synonyms: 1,1',1''-(2-bromoethene-1,1,2-triyl)tribenzene
Smiles: Br/C(=C(/c1ccccc1)\c1ccccc1)/c1ccccc1

STK687643
Synonyms: 1-(methylsulfonyl)-4-nitrobenzene
Smiles: [O-][N+](=O)c1ccc(cc1)S(=O)(=O)C

STK784054
Synonyms: N,N-dimethyl-4-(methylsulfonyl)aniline
Smiles: CN(c1ccc(cc1)S(=O)(=O)C)C

STK784055
Synonyms: 4-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}benzonitrile
Smiles: N#Cc1ccc(cc1)/C=C/c1ccc(cc1)N(C)C

STK687648
Synonyms: 3-(tert-butylsulfinyl)propanoicacid
Smiles: OC(=O)CCS(=O)C(C)(C)C

STK784056
Synonyms: 7-benzyl-2,6-dichloro-7H-purine
Smiles: Clc1nc(Cl)c2c(n1)ncn2Cc1ccccc1

STK687649
Synonyms: 1-[(1,3-dichloropropan-2-yl)sulfonyl]butane
Smiles: CCCCS(=O)(=O)C(CCl)CCl

STK784057
Synonyms: 1-({2-[2-(butylsulfonyl)ethoxy]ethyl}sulfonyl)butane
Smiles: CCCCS(=O)(=O)CCOCCS(=O)(=O)CCCC

STK784058
Synonyms: 1-[(2-{[2-(butylsulfonyl)ethyl]sulfinyl}ethyl)sulfonyl]butane
Smiles: CCCCS(=O)(=O)CCS(=O)CCS(=O)(=O)CCCC

STK687650
Synonyms: 1-[(2-{[2-(octylsulfonyl)ethyl]sulfanyl}ethyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCSCCS(=O)(=O)CCCCCCCC

STK687651
Synonyms: 1-ethyl-2,5-dimethylpiperidin-4-one
Smiles: CCN1CC(C)C(=O)CC1C

STK687654
Synonyms: 10-(thiophen-2-yl)decanoicacid
Smiles: OC(=O)CCCCCCCCCc1cccs1

STK784061
Synonyms: methyl6-[5-(5-methoxy-5-oxopentyl)thiophen-2-yl]hexanoate
Smiles: COC(=O)CCCCCc1ccc(s1)CCCCC(=O)OC

STK687657
Synonyms: 1-[(2-chloroethyl)sulfinyl]decane
Smiles: CCCCCCCCCCS(=O)CCCl

STK784065
Synonyms: 2-(ethylsulfonyl)ethylcarbamimidothioate
Smiles: CCS(=O)(=O)CCSC(=N)N

STK687660
Synonyms: 2,6-dibromo-3,5-dimethoxypyrazine
Smiles: COc1nc(OC)c(nc1Br)Br

STK784067
Synonyms: 3,5-dinitropyrazine-2,6-diamine
Smiles: Nc1nc(N)c(nc1[N+](=O)[O-])[N+](=O)[O-]

STK687661
Synonyms: 3,5-dimethoxy-2,6-dinitropyrazine1-oxide
Smiles: COc1nc(OC)c([n+](c1[N+](=O)[O-])[O-])[N+](=O)[O-]

STK784068
Synonyms: 5-amino-6-bromo-2,2-dimethyl-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: O=c1nc2SC(Cn2c(c1Br)N)(C)C

STK687662
Synonyms: 5-amino-1-(2-cyanoethyl)-1H-pyrazole-4-carbonitrile
Smiles: N#CCCn1ncc(c1N)C#N

STK687663
Synonyms: (butylsulfonyl)aceticacid
Smiles: CCCCS(=O)(=O)CC(=O)O

STK687664
Synonyms: 2-(octylsulfonyl)ethanol
Smiles: CCCCCCCCS(=O)(=O)CCO

STK687666
Synonyms: N-(acridin-9-yl)acetamide
Smiles: CC(=O)Nc1c2ccccc2nc2c1cccc2

STK687667
Synonyms: 1,1-di(biphenyl-4-yl)methanamine
Smiles: NC(c1ccc(cc1)c1ccccc1)c1ccc(cc1)c1ccccc1

STK687668
Synonyms: 1-(2,2-dichloroethenyl)-4-nitrobenzene
Smiles: ClC(=Cc1ccc(cc1)[N+](=O)[O-])Cl

STK687670
Synonyms: 2-(dodecylsulfanyl)ethanol
Smiles: CCCCCCCCCCCCSCCO

STK687671
Synonyms: 1-[(2,3-dichloropropyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CC(CCl)Cl

STK687673
Synonyms: 2-(decylsulfonyl)ethylcarbamimidothioate
Smiles: CCCCCCCCCCS(=O)(=O)CCSC(=N)N

STK687675
Synonyms: 2-(octylsulfonyl)ethyloctane-1-sulfonate
Smiles: CCCCCCCCS(=O)(=O)CCOS(=O)(=O)CCCCCCCC

STK784072
Synonyms: (1Z,2E)-N,N'-dihydroxy-1-phenylethane-1,2-diimine
Smiles: O/N=C(/c1ccccc1)\C=N\O

STK784073
Synonyms: 2,6-diamino-5-{[(E)-furan-2-ylmethylidene]amino}pyrimidin-4-ol
Smiles: Nc1nc(N)c(c(n1)O)/N=C/c1ccco1

STK687676
Synonyms: (2E)-2-[(5E)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylidene]hydrazinecarbothioamide
Smiles: NC(=S)N/N=C\1/C(=N/O)/CCc2c1non2

STK784074
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)acetamide
Smiles: CC(=O)Nc1cccc2c1non2

STK784093
Synonyms: 7-methyl-6-(4-methylphenyl)-2-phenylimidazo[1,2-b][1,2,4]triazine
Smiles: Cc1ccc(cc1)c1nc2n(c1C)nc(cn2)c1ccccc1

STK784098
Synonyms: 6-(4-hydroxyphenyl)-1-methyl-4-(3-nitrophenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: Oc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1cccc(c1)[N+](=O)[O-]

STK784100
Synonyms: 6-(4-ethylphenyl)-1-methyl-4-(3-nitrophenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: CCc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1cccc(c1)[N+](=O)[O-]

STK784101
Synonyms: 6-(3-chlorophenyl)-1-methyl-4-(3-nitrophenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: Clc1cccc(c1)N1CC2=C(C1=O)C(NC(=O)N2C)c1cccc(c1)[N+](=O)[O-]

STK784105
Synonyms: 6-(3,4-dimethylphenyl)-1-methyl-4-(3-nitrophenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: CN1C(=O)NC(C2=C1CN(C2=O)c1ccc(c(c1)C)C)c1cccc(c1)[N+](=O)[O-]

STK784107
Synonyms: 6-(3-hydroxyphenyl)-1-methyl-4-(3-nitrophenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: Oc1cccc(c1)N1CC2=C(C1=O)C(NC(=O)N2C)c1cccc(c1)[N+](=O)[O-]

STK784109
Synonyms: 4-(4-hydroxy-3-methoxyphenyl)-6-(4-methoxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: COc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccc(c(c1)OC)O

STK687677
Synonyms: 3-(1H-tetrazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-amine
Smiles: Nc1sc2c(c1c1nnn[nH]1)CCCC2

STK687679
Synonyms: 2-{1-[(4-hydroxyphenyl)amino]ethylidene}-1H-indene-1,3(2H)-dione
Smiles: C/C(=C/1\C(=O)c2c(C1=O)cccc2)/Nc1ccc(cc1)O

STK784112
Synonyms: 1-methyl-4-(3-nitrophenyl)-6-[3-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: O=C1NC(c2cccc(c2)[N+](=O)[O-])C2=C(N1C)CN(C2=O)c1cccc(c1)C(F)(F)F

STK784114
Synonyms: 3-amino-4-{[2-(piperidin-1-ylcarbonyl)phenyl]amino}-2H-chromen-2-one
Smiles: O=C(c1ccccc1Nc1c(N)c(=O)oc2c1cccc2)N1CCCCC1

STK687687
Synonyms: 2,6-dimethoxy-3,5-dinitropyridine
Smiles: COc1nc(OC)c(cc1[N+](=O)[O-])[N+](=O)[O-]

STK687689
Synonyms: 3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]-1-(3,5-dimethoxyphenyl)pyrrolidine-2,5-dione
Smiles: COc1cc(OC)cc(c1)N1C(=O)CC(C1=O)N1CCN(CC1)c1ccnc2c1ccc(c2)Cl

STK784116
Synonyms: 2-bromo-N-[2-(pyridin-4-yl)ethyl]benzamide
Smiles: O=C(c1ccccc1Br)NCCc1ccncc1

STK687691
Synonyms: 2-ethoxy-N-[2-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
Smiles: CCOc1ccccc1C(=O)Nc1ccc(cc1C)c1noc(n1)C

STK784121
Synonyms: (3E)-3-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one
Smiles: N=C1S/C(=C\2/C(=O)Nc3c2cccc3)/C(=O)N1c1nccs1

STK687694
Synonyms: methyl2-{2-[(4-chlorophenyl)amino]-2-oxoethyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
Smiles: COC(=O)C1Cc2cc(OC)c(cc2CN1CC(=O)Nc1ccc(cc1)Cl)OC

STK687695
Synonyms: N-(1,3-benzothiazol-2-yl)-2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)Nc1nc2c(s1)cccc2

STK687696
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Smiles: Cc1onc(c1)NC(=O)Cn1nc(c(c1C)Cl)C

STK784122
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Smiles: O=C(N1CCc2c(C1)cccc2)Cn1nc(c(c1C)Cl)C

STK784123
Synonyms: 3'-(4-fluorophenyl)-5,7-dimethyl-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)CSC21C(=O)Nc1c2cc(C)cc1C

STK687697
Synonyms: 5-fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one
Smiles: CC(=O)CC1(O)C(=O)Nc2c1cc(F)cc2

STK687699
Synonyms: N-[2-(diethylamino)ethyl]-2-(6H-indolo[2,3-b]quinoxalin-6-yl)acetamide
Smiles: CCN(CCNC(=O)Cn1c2ccccc2c2c1nc1ccccc1n2)CC

STK784124
Synonyms: 3'-acetyl-5'-(4-nitrobenzyl)-3'H-spiro[indole-3,2'-[1,3,4]oxadiazol]-2(1H)-one
Smiles: CC(=O)N1N=C(OC21C(=O)Nc1c2cccc1)Cc1ccc(cc1)[N+](=O)[O-]

STK784125
Synonyms: 3'-acetyl-5'-(4-bromophenyl)-3'H-spiro[indole-3,2'-[1,3,4]oxadiazol]-2(1H)-one
Smiles: Brc1ccc(cc1)C1=NN(C2(O1)C(=O)Nc1c2cccc1)C(=O)C

STK784128
Synonyms: naphthalen-2-yl(3-nitro-1H-pyrazol-1-yl)acetate
Smiles: O=C(Cn1ccc(n1)[N+](=O)[O-])Oc1ccc2c(c1)cccc2

STK784129
Synonyms: N-[4-(dimethylamino)-6-({[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}methyl)-1,3,5-triazin-2-yl]acetamide
Smiles: CC(=O)Nc1nc(COc2nsnc2N2CCOCC2)nc(n1)N(C)C

STK784135
Synonyms: 2-(4-bromophenyl)pyrido[2,3-b]pyrazine
Smiles: Brc1ccc(cc1)c1cnc2c(n1)cccn2

STK784136
Synonyms: (1S,2S,5R)-2-[4-(pyridin-3-yl)-5-thioxo-4,5-dihydro-1H-tetrazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nnn(c1=S)c1cccnc1

STK784140
Synonyms: N-[1-(propan-2-yl)-1H-pyrazol-4-yl]pyrazine-2-carboxamide
Smiles: O=C(c1cnccn1)Nc1cnn(c1)C(C)C

STK687701
Synonyms: 3-[(pyridin-2-ylmethyl)sulfanyl]-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Smiles: c1ccc(nc1)CSc1nnc2n1nc[nH]2

STK687702
Synonyms: 6,13-di(prop-2-yn-1-yl)-13,13a-dihydro-6H-phthalazino[1,2-b]quinazoline-5,8-dione
Smiles: C#CCN1C(=O)c2ccccc2C2N1C(=O)c1c(N2CC#C)cccc1

STK687704
Synonyms: 6-(4-methoxyphenyl)-3,7-dimethyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: COc1ccc(cc1)C1=Nn2c(C)nnc2SC1C

STK687710
Synonyms: 2-bromo-5-[(2,6-dimethylpiperidin-1-yl)carbonyl]-N-phenylbenzenesulfonamide
Smiles: CC1CCCC(N1C(=O)c1ccc(c(c1)S(=O)(=O)Nc1ccccc1)Br)C

STK687719
Synonyms: 2-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)c1[nH]nc(c1)c1nn2c(n1)c1c(nc2)sc2c1CCC2