FULL DB

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

STL040205
Synonyms: (1E,2E)-1-{1-[2-(diethylammonio)ethyl]-2-(3,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}-3-phenylprop-2-en-1-olate
Smiles: COc1cc(ccc1OC)C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\C=C\c1ccccc1)/[O-]

STL040206
Synonyms: N-benzyl-2-[(5E)-5-{[(4-ethoxyphenyl)carbamoyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
Smiles: CCOc1ccc(cc1)NC(=O)/N=c/1\[nH]nc(s1)CC(=O)NCc1ccccc1

STL040207
Synonyms: 6-hydroxy-8-{(2E)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-7-(4-methylbenzyl)-3,7-dihydro-2H-purin-2-one
Smiles: Cc1ccc(cc1)Cn1c(N/N=C(/c2ccc(cc2)O)\C)nc2c1c(O)nc(=O)n2C

STL040208
Synonyms: 4-{(E)-[2-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-ethoxyphenolate
Smiles: CCOc1cc(/C=N/NC(=O)CSc2[nH+]nc(n2CC)c2ccc(cc2)Cl)ccc1[O-]

STL040209
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-2-(2-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-2-methylphenyl)methanolate
Smiles: CCOc1ccccc1C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OC)/[O-]

STL040210
Synonyms: (5Z)-3-(3,4-dimethylphenyl)-6-hydroxy-5-{[(4-methylpiperazin-1-yl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CN1CCN(CC1)N/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O

STL040211
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}methanolate
Smiles: C[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/[O-])/C1c1ccncc1)C

STL040212
Synonyms: N-[(Z)-amino{[(2Z)-4,6-dimethylquinazolin-2(3H)-ylidene]amino}methylidene]-2-phenylacetamide
Smiles: Cc1ccc2c(c1)c(C)[nH]/c(=N/C(=N\C(=O)Cc1ccccc1)/N)/n2

STL040214
Synonyms: N-(2,5-dimethylphenyl)-4-methoxy-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc(cc1)C(=O)N(c1cc(C)ccc1C)Cc1cc2cc(C)ccc2[nH]c1=O

STL040215
Synonyms: (5E)-5-{[1-(4-chlorobenzyl)-1H-indol-3-yl]methylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STL040216
Synonyms: methyl2-{(3E)-2-(4-ethoxyphenyl)-3-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(c(c2)C)OC)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC

STL040217
Synonyms: (5E)-5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-2-sulfanyl-1,3-thiazol-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2cc(n(c2C)c2cccc(c2)[N+](=O)[O-])C)/S1

STL040218
Synonyms: ethyl2-{(3E)-2-(3-bromophenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(c2cccc(c2)Br)/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STL040219
Synonyms: 7-(4-fluorophenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Fc1ccc(cc1)C1C=C(N=c2n1nc[nH]2)c1ccccc1

STL040220
Synonyms: (E)-[4,5-dioxo-1-(pyridinium-3-ylmethyl)-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene][5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: CCOC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cc(OC)c(c(c1)OC)OC)Cc1ccc[nH+]c1)/[O-])C

STL040221
Synonyms: (E)-{2-(3-bromophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: CCOC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)CCCn1cc[nH+]c1)/[O-])C

STL040222
Synonyms: N-(2,5-dimethylphenyl)-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccccc1)Cc1cc2cc(C)ccc2[nH]c1=O)C

STL040223
Synonyms: 3-chloro-N-[(1Z)-4-[4-methyl-3-(piperidin-1-ylsulfonyl)phenyl]phthalazin-1(2H)-ylidene]aniline
Smiles: Clc1cccc(c1)/N=c/1\[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCCCC1)C

STL040225
Synonyms: (4E)-5-(3,4-dichlorophenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)c1nccs1)/O

STL040226
Synonyms: 4-{(E)-[2-({[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)C(=O)[O-])[nH+]nc1c1ccc(cc1)Cl

STL040227
Synonyms: (E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}[4-(morpholin-4-ylsulfonyl)phenyl]methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccc(cc2)S(=O)(=O)N2CCOCC2)/[O-])/C(N1CC[NH+]1CCOCC1)c1cccs1

STL040228
Synonyms: methyl5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-hydroxy-4-(4-methylphenyl)-3,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)CSC1=C(C#N)C(C(C(=N1)O)C(=O)OC)c1ccc(cc1)C

STL040229
Synonyms: (5E)-5-({[2-(4-acetylpiperazin-1-yl)ethyl]amino}methylidene)-6-hydroxy-3-(naphthalen-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\NCCN2CCN(CC2)C(=O)C)/C(=O)N1c1cccc2c1cccc2

STL040230
Synonyms: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methylphenyl)methylidene]-5-(2-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccccc1C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C

STL040232
Synonyms: 2-[(2E)-1,3-benzoxazol-2(3H)-ylideneamino]-N-(2-methoxyphenyl)-4,6-dimethylpyrimidine-5-carboxamide
Smiles: COc1ccccc1NC(=O)c1c(C)nc(nc1C)/N=c\1/oc2c([nH]1)cccc2

STL040234
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-2-(3-methoxy-4-propoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: CCCOc1ccc(cc1OC)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CCC[NH+](CC)CC

STL040235
Synonyms: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-ethoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=NC(=O)/C(=C/c2nc3c([nH]2)cccc3)/C1=O)S

STL040236
Synonyms: (E)-[4-(benzyloxy)-2-methylphenyl]{1-[2-(dimethylammonio)ethyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: C[NH+](CCN1C(c2ccc(cc2)F)/C(=C(/c2ccc(cc2C)OCc2ccccc2)\[O-])/C(=O)C1=O)C

STL040237
Synonyms: 2-bromo-4-{(E)-[2-({[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-methoxyphenolate
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)N/N=C/c2cc(Br)c(c(c2)OC)[O-])[nH+]nc1c1ccc(cc1)Cl

STL040238
Synonyms: 3-(ethoxycarbonyl)-2-methyl-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium
Smiles: CCOC(=O)c1cc2[nH]c3c(c2[n+](c1C)c1ccc(cc1)[N+](=O)[O-])cccc3

STL040239
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(2-hydroxyethyl)-5-phenylpyrrolidine-2,3-dione
Smiles: OCCN1C(c2ccccc2)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STL040240
Synonyms: 5-(4-tert-butylphenyl)-4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: [O-][N+](=O)c1cc(ccc1Cl)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C

STL040242
Synonyms: (E)-[2-(4-ethoxy-3-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](5-methylfuran-2-yl)methanolate
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccc(o2)C)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL040243
Synonyms: 2,6-dibromo-3-hydroxy-4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-7-ium-2-yl)phenolate
Smiles: C[NH+]1CCc2c(C1)sc1c2C(=NC(N1)c1cc(Br)c(c(c1O)Br)[O-])O

STL040244
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-2-(4-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate
Smiles: CCOc1ccc(cc1)C1N(CCC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2)/[O-]

STL040246
Synonyms: 2-ethoxy-6-[(E)-(2-{[(1-methyl-1H-3,1-benzimidazol-3-ium-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: CCOc1cccc(c1[O-])/C=N/NC(=O)CSc1[nH+]c2c(n1C)cccc2

STL040247
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)OCCC)CC[NH+](CC)CC)/[O-]

STL040248
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}[3-methyl-4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC[NH+](CCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc(c(c2)C)OCC(C)C)\[O-])/C(=O)C1=O)CC

STL040249
Synonyms: 3-{3-(furan-2-ylcarbonyl)-4-hydroxy-1-[3-(morpholin-4-ium-4-yl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}phenolate
Smiles: [O-]c1cccc(c1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=C1C(=O)c1ccco1)O

STL040250
Synonyms: (E)-{2-(4-chlorophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate
Smiles: C[NH+](CCCN1C(c2ccc(cc2)Cl)/C(=C(/c2c(C)nc3n2cccc3)\[O-])/C(=O)C1=O)C

STL040251
Synonyms: (5Z)-6-hydroxy-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-3-(4-iodophenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Ic1ccc(cc1)N1C(=O)N=C(/C(=C/NCCc2c[nH]c3c2cccc3)/C1=O)O

STL040252
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-3-methylphenyl)methanolate
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)CC[NH+](C)C)/[O-]

STL040253
Synonyms: N-(2-fluorobenzyl)-4-hydroxy-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Smiles: Fc1ccccc1CNC(=O)c1c(=O)c2cccc3c2n(c1O)CC3

STL040255
Synonyms: 2,4-dibromo-6-{(E)-[2-({[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Smiles: O=C(CSc1[nH+]nc(n1c1ccccc1)c1ccc(cc1)Cl)N/N=C/c1cc(Br)cc(c1[O-])Br

STL040256
Synonyms: N-{4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(2-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1[N+](=O)[O-]

STL040257
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(4-ethoxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STL040258
Synonyms: 6-hydroxy-7-octyl-3,4-dihydro-2H,8H-pyrimido[2,1-b][1,3]thiazin-8-one
Smiles: CCCCCCCCc1c(=O)nc2n(c1O)CCCS2

STL040259
Synonyms: 1-{(E)-[2-({[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}naphthalen-2-olate
Smiles: COc1cc(cc(c1OC)OC)c1n[nH+]c(n1c1ccccc1)SCC(=O)N/N=C/c1c([O-])ccc2c1cccc2

STL040260
Synonyms: (5Z)-6-hydroxy-3-(2-methoxyphenyl)-5-({[2-(piperidin-1-yl)ethyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C/NCCN2CCCCC2)/C1=O)O

STL040261
Synonyms: (E)-[4-(benzyloxy)-3-methylphenyl][2-(3-ethoxy-4-hydroxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccc[nH+]c2)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)C)OCc1ccccc1)/[O-]

STL040262
Synonyms: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(2-methoxyethyl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC)/O)/C1c1ccc(cc1)C

STL040263
Synonyms: 6-hydroxy-3-methyl-7-(3-methylbenzyl)-8-(4-methylpiperazin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1cccc(c1)C)c(O)nc(=O)n2C

STL040264
Synonyms: (5E)-3-(3-chloro-4-methylphenyl)-6-hydroxy-5-{[1-(3-methylbenzyl)-1H-pyrrol-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1cccc(c1)Cn1cccc1/C=C/1\C(=NC(=O)N(C1=O)c1ccc(c(c1)Cl)C)O

STL040265
Synonyms: N-(2,5-dimethylphenyl)-2-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccccc1C)Cc1cc2cccc(c2[nH]c1=O)C)C

STL040266
Synonyms: 4-{(1E)-1-[2-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]propyl}phenolate
Smiles: CCn1c(SCC(=O)N/N=C(/c2ccc(cc2)[O-])\CC)[nH+]nc1c1ccc(cc1)Cl

STL040267
Synonyms: (5Z)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C\Nc1cccc2c1nsn2)c1ccccc1C

STL040268
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2c(C)nc3n2cccc3)/[O-])/C1c1ccccc1)CC

STL040269
Synonyms: (4E)-1-(3-chlorophenyl)-5-(2,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1cccc(c1)Cl

STL040270
Synonyms: (E)-{2-(4-hydroxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}[2-methyl-4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)CCC[NH+]1CCOCC1)/[O-])C

STL040272
Synonyms: 6-hydroxy-3-methyl-7-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}-8-(pyrrolidin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: Oc1nc(=O)n(c2c1n(CCCSc1nnnn1c1ccccc1)c(n2)N1CCCC1)C

STL040273
Synonyms: (4Z)-4-{[6-methyl-2-(piperidin-1-yl)quinolin-3-yl]methylidene}-2-sulfanyl-4H-imidazol-5-ol
Smiles: OC1=NC(=N/C/1=C\c1cc2cc(C)ccc2nc1N1CCCCC1)S

STL040274
Synonyms: (5E)-1-(2,5-dimethoxyphenyl)-5-(3-ethoxy-4-hydroxybenzylidene)-2-hydroxypyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1cc(ccc1O)/C=C/1\C(=O)N=C(N(C1=O)c1cc(OC)ccc1OC)O

STL040275
Synonyms: 4-chloro-2-[(E)-{[3-(methoxycarbonyl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl]imino}methyl]phenolate
Smiles: COC(=O)c1c(/N=C/c2cc(Cl)ccc2[O-])sc2c1CC[NH+](C2)C

STL040276
Synonyms: 2-fluoro-N-methyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: CN(C(=O)c1ccccc1F)Cc1cc2ccccc2[nH]c1=O

STL040277
Synonyms: [3-(6-bromo-2-hydroxy-4-phenylquinolin-3-yl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl](2,4-dichlorophenyl)methanone
Smiles: Clc1ccc(c(c1)Cl)C(=O)N1N=C(CC1c1ccco1)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Br

STL040278
Synonyms: N-tert-butyl-2-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(C)(C)C)C(=O)c1ccccc1C

STL040279
Synonyms: N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]furan-2-carboxamide
Smiles: COc1ccc(cc1)N(C(=O)c1ccco1)Cc1cc2ccc(cc2[nH]c1=O)C

STL040280
Synonyms: (4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(phenyl)methylidene]-5-phenylpyrrolidine-2,3-dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(c2ccccc2)/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STL040281
Synonyms: (4E)-4-{[4-(benzyloxy)-2-methylphenyl](hydroxy)methylidene}-5-(4-tert-butylphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccc(cc2C)OCc2ccccc2)\O)/C(=O)C1=O

STL040282
Synonyms: (E)-[2-(4-bromophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](phenyl)methanolate
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL040283
Synonyms: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[furan-2-yl(hydroxy)methylidene]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)C)/C(=C(/c2ccco2)\O)/C(=O)C1=O

STL040284
Synonyms: 2-chloro-5-methylphenylP-methyl-N-phenylphosphonamidate
Smiles: Cc1ccc(c(c1)OP(=O)(Nc1ccccc1)C)Cl

STL040286
Synonyms: (2E)-6-chloro-2-{(2E)-[(2-chloro-7-ethoxyquinolin-3-yl)methylidene]hydrazinylidene}-4-phenyl-2,3-dihydroquinazoline
Smiles: CCOc1ccc2c(c1)nc(c(c2)/C=N/N=c\1/nc2ccc(cc2c([nH]1)c1ccccc1)Cl)Cl

STL040288
Synonyms: (E)-[4-(benzyloxy)-2-methylphenyl]{1-[2-(dimethylammonio)ethyl]-2-(4-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1ccc(cc1)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/[O-]

STL040289
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(7-methoxy-1-benzofuran-2-yl)methanolate
Smiles: COc1cccc2c1oc(c2)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCC[NH+](CC)CC)/[O-]

STL040290
Synonyms: (4E)-5-(4-tert-butylphenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(cc1)C(C)(C)C

STL040291
Synonyms: (E)-[2-(3-bromophenyl)-4,5-dioxo-1-(pyridinium-2-yl)pyrrolidin-3-ylidene](4-methoxyphenyl)methanolate
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)c1cccc[nH+]1)/[O-]

STL040292
Synonyms: (E)-1-benzofuran-2-yl{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1cccc(c1)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/[O-]

STL040293
Synonyms: ethyl2-[(3E)-3-[hydroxy(phenyl)methylidene]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(c2cccs2)/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STL040294
Synonyms: (5E)-5-(4-hydroxy-3-iodobenzylidene)-2-sulfanyl-1,3-thiazol-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2ccc(c(c2)I)O)/S1

STL040296
Synonyms: N-(2-{[(2Z)-1-methyl-1,3-dihydro-2H-benzimidazol-2-ylidene]carbamoyl}phenyl)furan-2-carboxamide
Smiles: O=C(c1ccccc1NC(=O)c1ccco1)/N=c\1/[nH]c2c(n1C)cccc2

STL040299
Synonyms: 3-methyl-2-sulfanyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cn1c(S)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STL040300
Synonyms: (4E)-4-[(3-chloro-4-methoxyphenyl)(hydroxy)methylidene]-5-(2,3-dimethoxyphenyl)-1-(4,5-dimethyl-1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1c(OC)cccc1C1N(c2nc(c(s2)C)C)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)Cl)OC)/O

STL040301
Synonyms: [(4-chlorophenyl)sulfonyl]{3-[3-(prop-2-en-1-yl)-1H-imidazol-3-ium-1-yl]quinoxalin-2-yl}azanide
Smiles: C=CC[n+]1ccn(c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccc(cc1)Cl

STL040302
Synonyms: (E)-1-benzofuran-2-yl{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}methanolate
Smiles: CC[NH+](CCCN1C(c2ccncc2)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)CC

STL040303
Synonyms: 8-[(3-ethoxypropyl)amino]-6-hydroxy-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: C=CCn1c(NCCCOCC)nc2c1c(O)nc(=O)n2C

STL040305
Synonyms: 1-(3,4-dichlorophenyl)-3-[(2E)-5-(2-fluorophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: O=C(/N=c/1\[nH]nc(s1)c1ccccc1F)Nc1ccc(c(c1)Cl)Cl

STL040306
Synonyms: (E)-{2-(3-fluorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: COC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)F)CC[NH+]1CCOCC1)/[O-])C

STL040307
Synonyms: 4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-7-ium-2-yl)-2,6-dimethoxyphenolate
Smiles: COc1cc(cc(c1[O-])OC)C1N=C(O)c2c(N1)sc1c2CC[NH+](C1)C

STL040308
Synonyms: 1-methyl-3-(4-{4'-[2-(1-methyl-1H-indol-3-yl)-4-phenyl-4H-imidazol-5-yl]biphenyl-4-yl}-5-phenyl-1H-imidazol-2-yl)-1H-indole
Smiles: Cn1cc(c2c1cccc2)C1=NC(C(=N1)c1ccc(cc1)c1ccc(cc1)c1nc([nH]c1c1ccccc1)c1cn(c2c1cccc2)C)c1ccccc1

STL040309
Synonyms: 7-(2-chloro-6-fluorophenyl)-5-(4-methoxyphenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1=CC(n2c(=N1)[nH]cn2)c1c(F)cccc1Cl

STL040310
Synonyms: 6-bromo-4-phenyl-3-(piperidin-1-yl)quinolin-2-ol
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)N1CCCCC1

STL040311
Synonyms: (5Z)-5-[4-(diethylamino)-2-methoxybenzylidene]-1-(4-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1cc(ccc1/C=C\1/C(=O)N=C(N(C1=O)c1ccc(cc1)F)S)N(CC)CC

STL040312
Synonyms: 8-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-6-hydroxy-3-methyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccccc1/C=N/Nc1nc2c(n1Cc1cccc3c1cccc3)c(O)nc(=O)n2C

STL040313
Synonyms: 7-(2-chlorobenzyl)-8-{[2-(dimethylamino)ethyl]amino}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CN(CCNc1nc2c(n1Cc1ccccc1Cl)c(O)nc(=O)n2C)C

STL040314
Synonyms: 1-[11-(2-ethoxyphenyl)-1-hydroxy-3-(4-methoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2,2,2-trifluoroethanone
Smiles: CCOc1ccccc1C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(F)(F)F)cccc2)c1ccc(cc1)OC

STL040315
Synonyms: 8-(benzylsulfanyl)-6-hydroxy-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COCCn1c(SCc2ccccc2)nc2c1c(O)nc(=O)n2C

STL040318
Synonyms: (phenylsulfonyl){3-[3-(propan-2-yl)-1H-imidazol-3-ium-1-yl]quinoxalin-2-yl}azanide
Smiles: CC([n+]1ccn(c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1)C

STL040320
Synonyms: 1-[1-hydroxy-3,3-dimethyl-11-(4-nitrophenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2-phenylethanone
Smiles: OC1=C2C(=Nc3c(N(C2c2ccc(cc2)[N+](=O)[O-])C(=O)Cc2ccccc2)cccc3)CC(C1)(C)C

STL040321
Synonyms: (5Z)-2,6-dihydroxy-5-{4-[(5-nitropyridin-2-yl)oxy]benzylidene}pyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C\c2ccc(cc2)Oc2ccc(cn2)[N+](=O)[O-])/C(=N1)O

STL040322
Synonyms: (4E)-5-(2,4-dimethoxyphenyl)-1-(4-fluorophenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(cc1)F

STL040323
Synonyms: 1-[(E)-{[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]imino}methyl]naphthalen-2-olate
Smiles: [O-]c1ccc2c(c1/C=N/N1CC[NH+](CC1)Cc1cccc3c1cccc3)cccc2

STL040324
Synonyms: (4E)-5-(2-fluorophenyl)-4-[hydroxy(4-methylphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccccc2F)N(C(=O)C1=O)c1noc(c1)C)/O

STL040325
Synonyms: (E)-(4-fluorophenyl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}methanolate
Smiles: Fc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CC[NH+]1CCOCC1)/[O-]

STL040326
Synonyms: 4-{(E)-[2-({[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Smiles: CCn1c(SCC(=O)N/N=C/c2ccc(cc2)[O-])[nH+]nc1c1ccc(cc1)C

STL040327
Synonyms: (E)-{2-(3,4-dichlorophenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[3-methyl-4-(propan-2-yloxy)phenyl]methanolate
Smiles: C[NH+](CCN1C(c2ccc(c(c2)Cl)Cl)/C(=C(/c2ccc(c(c2)C)OC(C)C)\[O-])/C(=O)C1=O)C

STL040328
Synonyms: 4-{(3E)-1-[2-(diethylammonio)ethyl]-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-4,5-dioxopyrrolidin-2-yl}-2-ethoxyphenolate
Smiles: CCOc1cc(ccc1[O-])C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OC)/O

STL040329
Synonyms: (E)-1-benzofuran-2-yl{2-(4-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccc(cc1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/[O-]

STL040330
Synonyms: 8-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-pentyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)C(=O)c1ccco1

STL040331
Synonyms: (5Z)-5-(4-chlorobenzylidene)-3-(6-methyl-1,3-benzothiazol-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Smiles: Clc1ccc(cc1)/C=C/1\N=C(N(C1=O)c1nc2c(s1)cc(cc2)C)S

STL040332
Synonyms: (E)-{2-(4-fluorophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}[5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: COC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)CCCn1cc[nH+]c1)/[O-])C

STL040333
Synonyms: 1-(2,4-dichlorophenyl)-3-[(2E)-5-[(4-methylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Cc1ccc(cc1)OCc1n[nH]/c(=N\C(=O)Nc2ccc(cc2Cl)Cl)/s1

STL040334
Synonyms: (4E)-5-(2,5-dimethoxyphenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2cc(OC)ccc2OC)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)OC)/O

STL040335
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-2-(3,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-fluorophenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)F)/[O-])/C1c1ccc(c(c1)OC)OC)CC

STL040336
Synonyms: 4-[3-(3-bromophenyl)-1-hydroxy-11-(4-methylphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2cccc(c2)Br)C1c1ccc(cc1)C

STL040337
Synonyms: (4E)-4-[furan-2-yl(hydroxy)methylidene]-1-(2-methoxyethyl)-5-phenylpyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccccc1

STL040338
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-[4-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}(5-methylfuran-2-yl)methanolate
Smiles: C=CCOc1ccc(cc1)C1/C(=C(/c2ccc(o2)C)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STL040340
Synonyms: 4-fluoro-N-(5-methyl-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1nn2c(=NC(=CC2c2ccccc2)C)[nH]1

STL040341
Synonyms: (E)-(2,4-dimethyl-1,3-thiazol-5-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}methanolate
Smiles: Cc1nc(c(s1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)CC[NH+]1CCOCC1)/[O-])C

STL040342
Synonyms: 5-(phenoxymethyl)-4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CC(c1ccc(cc1)/C=N/n1c(COc2ccccc2)n[nH]c1=S)C

STL040343
Synonyms: (4E)-5-(3-chlorophenyl)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}pyrrolidine-2,3-dione
Smiles: Clc1cccc(c1)C1N(c2ncc(s2)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])C(=O)C(=O)/C/1=C(\c1ccc(cc1)Cl)/O

STL040344
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}[3-methyl-4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC[NH+](CCN1C(c2ccc(cc2)F)/C(=C(/c2ccc(c(c2)C)OCC(C)C)\[O-])/C(=O)C1=O)CC

STL040345
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-N-[(2Z)-4-phenyl-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=c/1\scc([nH]1)c1ccccc1)CN1CCN(CC1)c1ccccc1F

STL040346
Synonyms: (E)-(4-bromophenyl){1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-[4-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Smiles: C=CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Br)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL040347
Synonyms: N-(4-bromophenyl)-2-{[3-cyano-6-hydroxy-4-(3-nitrophenyl)-4,5-dihydropyridin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)N=C(CC1c1cccc(c1)[N+](=O)[O-])O

STL040348
Synonyms: N-(2,4-dimethylphenyl)-2-methyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Cc1ccc(c(c1)C)N(C(=O)c1ccccc1C)Cc1cc2ccccc2[nH]c1=O

STL040349
Synonyms: 4-hydroxy-1,3-dimethyl-5-(naphthalen-1-yl)-3,5-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,6-dione
Smiles: O=C1c2ccccc2C2=C1C(c1cccc3c1cccc3)c1c(=N2)n(C)c(=O)n(c1O)C

STL040350
Synonyms: (E)-{2-(2,5-dimethoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-2-methylphenyl)methanolate
Smiles: COc1ccc(c(c1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OC)/[O-])OC

STL040351
Synonyms: 2,4-dibromo-6-{(E)-[(2Z)-[1,2,4]triazolo[3,4-a]phthalazin-6(5H)-ylidenehydrazinylidene]methyl}phenol
Smiles: Brc1cc(/C=N/N=c/2\[nH]n3cnnc3c3c2cccc3)c(c(c1)Br)O

STL040353
Synonyms: {1-hydroxy-3,3-dimethyl-11-[4-(trifluoromethyl)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}(phenyl)methanone
Smiles: OC1=C2C(=Nc3c(N(C2c2ccc(cc2)C(F)(F)F)C(=O)c2ccccc2)cccc3)CC(C1)(C)C

STL040355
Synonyms: (E)-[4-(benzyloxy)-2-methylphenyl]{2-(4-hydroxy-3-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1cc(ccc1O)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/[O-]

STL040356
Synonyms: 5-(4-methoxyphenyl)-4-{[(E)-(2-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccc1OC

STL040357
Synonyms: (E)-(2,4-dimethyl-1,3-thiazol-5-yl){2-(4-ethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1ccc(cc1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[O-]

STL040358
Synonyms: (E)-{2-(furan-2-yl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)CC[NH+]1CCOCC1)/[O-]

STL040359
Synonyms: 4-{[(1E)-4-{3-[(2-hydroxyethyl)sulfamoyl]-4-methylphenyl}phthalazin-1(2H)-ylidene]amino}benzamide
Smiles: OCCNS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N/c2ccc(cc2)C(=O)N)/c2c1cccc2

STL040360
Synonyms: (2,6-dichloro-4-{(E)-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}phenoxy)aceticacid
Smiles: OC(=O)COc1c(Cl)cc(cc1Cl)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)F)S

STL040361
Synonyms: 3-(4-chlorophenyl)-2,6-dihydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4(3H)-one
Smiles: Clc1ccc(cc1)n1c(O)nc(c(c1=O)C1NCCc2c1cccc2)O

STL040362
Synonyms: 3-{(2Z)-2-[(2E)-(2-chlorobenzylidene)hydrazinylidene]-2,3-dihydro-1,3-thiazol-4-yl}-2H-chromen-2-one
Smiles: Clc1ccccc1/C=N/N=c/1\scc([nH]1)c1cc2ccccc2oc1=O

STL040363
Synonyms: 1-(2,4-dichlorophenyl)-3-[(2Z)-5-phenyl-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Clc1ccc(c(c1)Cl)NC(=O)/N=c\1/[nH]nc(s1)c1ccccc1

STL040364
Synonyms: N'-{(Z)-[1-(2-fluorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}pyridine-4-carbohydrazide
Smiles: O=C(c1ccncc1)NN/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1F)O

STL040365
Synonyms: prop-2-en-1-yl2-{(3E)-2-(4-ethoxy-3-methoxyphenyl)-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOC(=O)c1sc(nc1C)N1C(c2ccc(c(c2)OC)OCC)/C(=C(/c2ccc(cc2C)OC)\O)/C(=O)C1=O

STL040366
Synonyms: methyl2-{(3E)-2-(3-chlorophenyl)-3-[(4-chlorophenyl)(hydroxy)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1cccc(c1)Cl

STL040367
Synonyms: 2-{[5-acetyl-3-cyano-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridin-2-yl]sulfanyl}-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]acetamide
Smiles: N#CC1=C(SCC(=O)/N=c\2/sc3c([nH]2)cccc3)NC(=C(C1c1ccccc1[N+](=O)[O-])C(=O)C)C

STL040368
Synonyms: (E)-[4-(benzyloxy)-3-methylphenyl]{2-(2,4-dichlorophenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Clc1ccc(c(c1)Cl)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)C)OCc1ccccc1)/[O-]

STL040369
Synonyms: (4E)-5-(4-chlorophenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)C(=O)/C/1=C(\c1ccco1)/O

STL040370
Synonyms: methyl2-{5-[(Z)-(4-oxo-2-sulfanyl-1,3-thiazol-5(4H)-ylidene)methyl]furan-2-yl}benzoate
Smiles: COC(=O)c1ccccc1c1ccc(o1)/C=C/1\SC(=NC1=O)S

STL040371
Synonyms: (4E)-1-benzyl-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: CC(CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1Cc1ccccc1)C

STL040372
Synonyms: (E)-[2-(3-chlorophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: CCOC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)Cc1ccc[nH+]c1)/[O-])C

STL040374
Synonyms: 5-(pyridin-3-yl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(ccc(c1OC)OC)/C=N/n1c(=S)[nH]nc1c1cccnc1

STL040375
Synonyms: 1-[(2Z)-5-(3-butoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(2-methoxyphenyl)urea
Smiles: CCCCOc1cccc(c1)c1n[nH]/c(=N/C(=O)Nc2ccccc2OC)/s1

STL040376
Synonyms: 3-{(E)-[(3-methylphenyl)imino]methyl}quinolin-2(1H)-one
Smiles: Cc1cccc(c1)/N=C/c1cc2ccccc2[nH]c1=O

STL040377
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)ccc2C)N=C2C(=C(O)CCC2)C1c1ccc(cc1)Cl

STL040378
Synonyms: 5-(furan-2-yl)-4-{[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccco2)cc(c1O)OC

STL040380
Synonyms: (2E,5Z)-2-[(2-methylphenyl)imino]-5-(pyridin-3-ylmethylidene)-2,5-dihydro-1,3-thiazol-4-ol
Smiles: OC1=N/C(=N\c2ccccc2C)/S/C/1=C\c1cccnc1

STL040381
Synonyms: 3,4,5-trimethoxy-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(3-methylphenyl)benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(c1cccc(c1)C)Cc1cc2ccc(cc2[nH]c1=O)C

STL040382
Synonyms: (E)-(3,4-dimethoxyphenyl){1-[3-(dimethylammonio)propyl]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1cccc(c1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)OC)OC)/[O-]

STL040386
Synonyms: (4Z)-4-[(2E)-(4-fluorobenzylidene)hydrazinylidene]-2-(pyridin-3-yl)-3,4-dihydroquinazoline
Smiles: Fc1ccc(cc1)/C=N/N=c/1\[nH]c(nc2c1cccc2)c1cccnc1

STL040387
Synonyms: 1-[3-(6-bromo-2-hydroxy-4-phenylquinolin-3-yl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: COc1ccc(cc1)C1CC(=NN1C(=O)C)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Br

STL040388
Synonyms: 2-{[2-(diethylamino)ethyl]sulfanyl}-5-heptylpyrimidine-4,6-diol
Smiles: CCCCCCCc1c(O)nc(nc1O)SCCN(CC)CC

STL040389
Synonyms: (E)-(5-methylfuran-2-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(3-propoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccc(o2)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STL040390
Synonyms: (E)-(4-chlorophenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STL040391
Synonyms: 1-[(2E)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-(2-methoxyphenyl)urea
Smiles: COc1ccccc1NC(=O)/N=c/1\[nH]nc(s1)C1CCCCC1

STL040392
Synonyms: 1-(2,4-dichlorophenyl)-3-[(2Z)-5-[(2-phenoxyethyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Clc1ccc(c(c1)Cl)NC(=O)/N=c\1/[nH]nc(s1)SCCOc1ccccc1

STL040393
Synonyms: (4E)-5-(2-fluorophenyl)-4-[hydroxy(4-methylphenyl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccccc1F

STL040396
Synonyms: 4-{(E)-[2-({[4-(4-bromophenyl)-5-phenyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Smiles: O=C(CSc1[nH+]nc(n1c1ccc(cc1)Br)c1ccccc1)N/N=C/c1ccc(cc1)[O-]

STL040397
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-phenylpropanamide
Smiles: CCC(=O)N(c1ccccc1)Cc1cc2ccc(cc2[nH]c1=O)C

STL040398
Synonyms: 2-(hexylsulfanyl)-6-hydroxy-4-phenyl-4,5-dihydropyridine-3-carbonitrile
Smiles: CCCCCCSC1=C(C#N)C(CC(=N1)O)c1ccccc1

STL040399
Synonyms: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[furan-2-yl(hydroxy)methylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)OC)/C(=C(/c2ccco2)\O)/C(=O)C1=O

STL040400
Synonyms: (E)-(7-methoxy-1-benzofuran-2-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1cccc2c1oc(c2)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CC[NH+]1CCOCC1)/[O-]

STL040401
Synonyms: N-(2,5-dimethylphenyl)-2-hydroxy-4-oxo-1-propyl-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCn1c(O)c(C(=O)Nc2cc(C)ccc2C)c(=O)c2c1cccc2

STL040402
Synonyms: 4-{[(E)-(2,4-dichlorophenyl)methylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1Cl)Cl

STL040403
Synonyms: 2-phenoxy-N-[(2E)-5-(2-phenylethyl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=c/1\[nH]nc(s1)CCc1ccccc1)COc1ccccc1

STL040404
Synonyms: 2-{(E)-[2-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: CCn1c(SCC(=O)N/N=C/c2ccccc2C(=O)[O-])[nH+]nc1c1ccc(cc1)Cl

STL040405
Synonyms: 2-{(4E)-4-[(2-hydroxyphenyl)imino]-3,4-dihydroquinazolin-2-yl}phenol
Smiles: Oc1ccccc1/N=c\1/[nH]c(nc2c1cccc2)c1ccccc1O

STL040406
Synonyms: 7-benzyl-4-hydroxy-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Smiles: O=c1nc(O)c2c(n1CCc1ccccc1)NC(=NC2(C(F)(F)F)C(F)(F)F)Cc1ccccc1

STL040407
Synonyms: (E)-{2-(2,5-dimethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methanolate
Smiles: COc1ccc(c(c1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2C)/[O-])OC

STL040408
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2c(C)nc3n2cccc3)/[O-])/C1c1cccnc1)CC

STL040409
Synonyms: (E)-[4-(benzyloxy)-2-methylphenyl]{2-(4-ethoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/[O-]

STL040410
Synonyms: 4-{[(E)-(2-chlorophenyl)methylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccc1Cl

STL040411
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Smiles: CC[NH+](CCCN1C(c2cccnc2)/C(=C(/c2sc(nc2C)C)\[O-])/C(=O)C1=O)CC

STL040412
Synonyms: (2E,5Z)-2-[(2-chlorophenyl)imino]-5-(2,4-dimethoxybenzylidene)-2,5-dihydro-1,3-thiazol-4-ol
Smiles: COc1cc(OC)ccc1/C=C/1\S/C(=N/c2ccccc2Cl)/N=C1O

STL040413
Synonyms: 3-(1H-benzimidazol-2-yl)-8-[(3-methylpiperidinium-1-yl)methyl]-2-oxo-2H-chromen-7-olate
Smiles: CC1CCC[NH+](C1)Cc1c([O-])ccc2c1oc(=O)c(c2)c1nc2c([nH]1)cccc2

STL040414
Synonyms: 5-(furan-2-yl)-4-{[(E)-(2-methylphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccco1

STL040415
Synonyms: 5-{(4E)-4-[(3-chlorophenyl)imino]-3,4-dihydrophthalazin-1-yl}-2-methyl-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide
Smiles: Clc1cccc(c1)/N=c\1/[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NCC1CCCO1)C

STL040416
Synonyms: (E)-(3-chloro-4-methoxyphenyl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CC[NH+]1CCOCC1)/[O-]

STL040418
Synonyms: (2Z)-2-[(2E)-{[1-(2-phenoxyethyl)-1H-pyrrol-2-yl]methylidene}hydrazinylidene]-2,3-dihydro-1,3-benzothiazole
Smiles: c1ccc(cc1)OCCn1cccc1/C=N/N=c/1\sc2c([nH]1)cccc2

STL040419
Synonyms: 4-(2-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1c1ccccc1OC

STL040420
Synonyms: 7-butyl-6-hydroxy-3-methyl-8-(octadecylsulfanyl)-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCCCCCCCCCCCCCSc1nc2c(n1CCCC)c(O)nc(=O)n2C

STL040422
Synonyms: methyl3-{[(2-hydroxy-4-oxo-1-propyl-1,4-dihydroquinolin-3-yl)carbonyl]amino}thiophene-2-carboxylate
Smiles: CCCn1c(O)c(C(=O)Nc2ccsc2C(=O)OC)c(=O)c2c1cccc2

STL040423
Synonyms: 2-methoxy-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-propylbenzamide
Smiles: CCCN(C(=O)c1ccccc1OC)Cc1cc2cc(C)ccc2[nH]c1=O

STL040424
Synonyms: 6-oxo-4-(piperidinium-1-ylmethyl)-6,7,8,9,10,11-hexahydrocyclohepta[c]chromen-3-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCCC1)oc(=O)c1c2CCCCC1

STL040425
Synonyms: (E)-[5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}methanolate
Smiles: COC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CCC[NH+]1CCOCC1)/[O-])C

STL040426
Synonyms: (E)-{2-(4-tert-butylphenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2c(C)[nH]c(c2C)C(=O)OC)/[O-])/C1c1ccc(cc1)C(C)(C)C)CC

STL040427
Synonyms: (2E,5Z)-2-[(3,5-dichlorophenyl)imino]-5-[4-(prop-2-en-1-yloxy)benzylidene]-2,5-dihydro-1,3-thiazol-4-ol
Smiles: C=CCOc1ccc(cc1)/C=C/1\S/C(=N/c2cc(Cl)cc(c2)Cl)/N=C1O

STL040428
Synonyms: 4-chloro-N-(3-methoxyphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1cccc(c1)N(C(=O)c1ccc(cc1)Cl)Cc1cc2ccccc2[nH]c1=O

STL040429
Synonyms: ethyl(3-{(Z)-[1-(3-chlorophenyl)-3-hydroxy-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-1H-indol-1-yl)acetate
Smiles: CCOC(=O)Cn1cc(c2c1cccc2)/C=C\1/C(=NN(C1=O)c1cccc(c1)Cl)O

STL040430
Synonyms: (4E)-4-[(4-butoxy-3-methylphenyl)(hydroxy)methylidene]-5-(4-hydroxy-3-methoxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)O)CCOC)/O

STL040432
Synonyms: (E)-[2-(4-butoxy-3-ethoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL040433
Synonyms: (5E)-5-[4-(azepan-1-yl)benzylidene]-1-(3-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=NC(=O)/C(=C\c2ccc(cc2)N2CCCCCC2)/C1=O)S

STL040435
Synonyms: 5-[3-(6-bromo-2-hydroxy-4-phenylquinolin-3-yl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccccc1F)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Br

STL040436
Synonyms: 4-tert-butyl-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-propylbenzamide
Smiles: CCCN(C(=O)c1ccc(cc1)C(C)(C)C)Cc1cc2ccc(cc2[nH]c1=O)C

STL040438
Synonyms: (E)-(3-chloro-4-ethoxyphenyl){2-(furan-2-yl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)CCCn1cc[nH+]c1)/[O-]

STL040439
Synonyms: (E)-{1-[3-(morpholin-4-ium-4-yl)propyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Smiles: O=C1C(=O)/C(=C(\c2cccs2)/[O-])/C(N1CCC[NH+]1CCOCC1)c1cccc(c1)[N+](=O)[O-]

STL040440
Synonyms: 5-(3,4-dimethoxyphenyl)-4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1OC)/C=N/n1c(=S)[nH]nc1c1ccc(c(c1)OC)OC

STL040442
Synonyms: 2-(benzylsulfanyl)-5-cyclopentyl-5,6-dihydrobenzo[h]quinazolin-4-ol
Smiles: Oc1nc(SCc2ccccc2)nc2c1C(Cc1c2cccc1)C1CCCC1

STL040443
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(4-fluorophenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(c2ccc(cc2)F)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STL040444
Synonyms: 2-{2-[2-(4-bromophenoxy)ethoxy]phenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Smiles: Brc1ccc(cc1)OCCOc1ccccc1c1nc(O)c2c(n1)sc1c2CCCC1

STL040445
Synonyms: 2-(4-{[(1Z)-4-{4-methyl-3-[(tetrahydrofuran-2-ylmethyl)sulfamoyl]phenyl}phthalazin-1(2H)-ylidene]amino}phenyl)acetamide
Smiles: NC(=O)Cc1ccc(cc1)/N=c/1\[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NCC1CCCO1)C

STL040446
Synonyms: (E)-(3-chloro-4-ethoxyphenyl){1-[3-(diethylammonio)propyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}methanolate
Smiles: CCOc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CCC[NH+](CC)CC)/[O-]

STL040447
Synonyms: N-[(2E)-5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-methoxybenzamide
Smiles: COc1cc(ccc1OC)c1n[nH]/c(=N\C(=O)c2ccccc2OC)/s1

STL040448
Synonyms: 2-phenyl-N-[3-(propan-2-yloxy)propyl][1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: CC(OCCCNc1nc(nc2c1oc1c2cccc1)c1ccccc1)C

STL040449
Synonyms: 1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-2-methylbutan-1-amine
Smiles: CCC(C(c1nnc(o1)SCc1ccc(cc1Cl)Cl)N)C

STL040450
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(4-hydroxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)CC[NH+](C)C)/[O-]

STL040451
Synonyms: (4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[furan-2-yl(hydroxy)methylidene]-5-phenylpyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccco2)/O)/C(N1c1nnc(s1)SCc1ccccc1)c1ccccc1

STL040452
Synonyms: (5E)-6-hydroxy-5-{[(4-methoxy-2-methylphenyl)amino]methylidene}-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C\Nc2ccc(cc2C)OC)/C1=O)O

STL040453
Synonyms: 2-[4-(2-ethylpiperidin-1-yl)quinazolin-2-yl]phenol
Smiles: CCC1CCCCN1c1nc(nc2c1cccc2)c1ccccc1O

STL040454
Synonyms: 3-(3,4-dichlorophenyl)-1-{2-[(2,3-dimethylphenyl)amino]-2-oxoethyl}-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: O=C(Nc1cccc(c1C)C)Cn1cc([n+]2c1CCC2)c1ccc(c(c1)Cl)Cl

STL040455
Synonyms: N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(propan-2-yl)thiophene-2-carboxamide
Smiles: CC(N(C(=O)c1cccs1)Cc1cc2ccccc2[nH]c1=O)C

STL040456
Synonyms: 6,6-dimethyl-2-(thiophen-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Smiles: Oc1nc(nc2c1c1CC(C)(C)OCc1s2)c1cccs1

STL040457
Synonyms: 5-chloro-7-methyl-2'-(4-nitrophenyl)-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: Clc1cc(C)c2c(c1)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-]

STL040458
Synonyms: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(3-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(c2cccc(c2)O)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=O

STL040459
Synonyms: 3-(diphenylmethyl)1-methyl1-cyano-2-[4-(dimethylamino)phenyl]-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinoline-1,3-dicarboxylate
Smiles: COC(=O)C1(C#N)C(c2ccc(cc2)N(C)C)C(N2C1c1ccccc1C=C2)C(=O)OC(c1ccccc1)c1ccccc1

STL040460
Synonyms: methyl4-[6-amino-5-cyano-3-(3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate
Smiles: COc1cccc(c1)c1[nH]nc2c1C(c1ccc(cc1)C(=O)OC)C(=C(O2)N)C#N

STL040462
Synonyms: (5E)-3-(4-chlorophenyl)-6-hydroxy-5-{1-[(3-hydroxypropyl)amino]propylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: OCCCN/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/CC

STL040463
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STL040464
Synonyms: (5E)-3-(4-chlorophenyl)-5-{1-[(2,4-dimethoxyphenyl)amino]propylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/Nc1ccc(cc1OC)OC

STL040465
Synonyms: (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1-ethyl-1H-indol-3-yl)methylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1OC)CCN1C(=O)N=C(/C(=C\c2cn(c3c2cccc3)CC)/C1=O)O

STL040466
Synonyms: (1'S,2'S,3R,3a'R)-1'-[(4-nitrophenyl)carbonyl]-2'-[(4-pentylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: CCCCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)[N+](=O)[O-])N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STL040468
Synonyms: 1-(4-fluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Fc1ccc(cc1)C(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STL040469
Synonyms: (5E)-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C/1\C(=NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC)O

STL040470
Synonyms: N-[(2E)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-phenoxyacetamide
Smiles: O=C(/N=c/1\[nH]nc(s1)C1CCCCC1)COc1ccccc1

STL040471
Synonyms: N'-[(E)-(2-methoxyphenyl)methylidene]-4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-]

STL040472
Synonyms: 8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-[4-(methoxycarbonyl)phenoxy]-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(c(c2=O)Oc1ccc(cc1)C(=O)OC)C(F)(F)F

STL040473
Synonyms: N-(4-methoxyphenyl)-4-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc(cc1)N(C(=O)c1ccc(cc1)C)Cc1cc2cccc(c2[nH]c1=O)C

STL040475
Synonyms: methyl2-{(3E)-2-(2-fluorophenyl)-3-[hydroxy(3-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccccc2F)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/O

STL040476
Synonyms: 1-{[5-(2-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,3-dimethylbutan-2-one
Smiles: C=CCn1c(SCC(=O)C(C)(C)C)nnc1c1ccccc1Cl

STL040477
Synonyms: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-(trifluoromethyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C(F)(F)F)CCC(=O)N1CCN(CC1)c1cccc(c1C)C

STL040478
Synonyms: (5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-(2-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccccc1N1C(=NC(=O)/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C1=O)S

STL040479
Synonyms: N-(2,5-dichlorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nnc1c1cccc(c1)C

STL040480
Synonyms: (5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C1=O)O

STL040481
Synonyms: 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1OC)/C=N/n1c(S)nnc1c1n[nH]c(c1)C

STL040482
Synonyms: (5Z)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]ethylidene}-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C(/NCc2ccc3c(c2)OCO3)\C)/C1=O)O

STL040483
Synonyms: 2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STL040484
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(furan-2-ylmethyl)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)Cc1ccco1)/O

STL040485
Synonyms: 2-hydroxy-12-(trifluoromethyl)-8,9,10,11-tetrahydro-1H-cyclohepta[e]thieno[2,3-b:4,5-b']dipyridin-4(7H)-one
Smiles: Oc1cc(=O)c2c([nH]1)c1c(s2)nc2c(c1C(F)(F)F)CCCCC2

STL040486
Synonyms: ethyl4-[4-(3-hydroxyphenyl)-3-methyl-6-oxo-2,6-dihydropyrrolo[3,4-c]pyrazol-5(4H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)C

STL040487
Synonyms: N'-[(E)-quinolin-6-ylmethylidene]pyrrolidine-2-carbohydrazide(non-preferredname)
Smiles: O=C(C1CCCN1)N/N=C/c1ccc2c(c1)cccn2

STL040488
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[3-(dimethylammonio)propyl]-2-(3-hydroxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Oc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

STL040489
Synonyms: 2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2OC)OC)nnc1c1cccc(c1)Cl

STL040490
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(2-hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1ccccc1O

STL040491
Synonyms: 3-chloro-N-[(2Z)-3-[(2,5-dimethoxyphenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: COc1ccc(c(c1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)Cl)OC

STL040492
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,5-difluorophenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)F

STL040493
Synonyms: (4E)-4-[hydroxy(3-methoxyphenyl)methylidene]-5-(4-nitrophenyl)-1-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)[N+](=O)[O-])N(C(=O)C1=O)c1ccccn1)/O

STL040494
Synonyms: (2E)-2-[(2E)-benzylidenehydrazinylidene]-3-(propan-2-yloxy)-2,3-dihydroquinazolin-4(1H)-one
Smiles: CC(On1/c(=N/N=C/c2ccccc2)/[nH]c2c(c1=O)cccc2)C

STL040495
Synonyms: N~4~-(4-methoxyphenyl)-N~2~-methyl-5-nitro-N~2~-phenylpyrimidine-2,4,6-triamine
Smiles: COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N(c1ccccc1)C

STL040496
Synonyms: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-({[2-(morpholin-4-ium-4-yl)ethyl]amino}methylidene)-4,6-dioxo-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: O=C1N=C([S-])N(C(=O)/C/1=C/NCC[NH+]1CCOCC1)CCC1=CCCCC1

STL040497
Synonyms: N-[(2Z)-3-[(4-bromo-2-methylphenyl)amino]quinoxalin-2(1H)-ylidene]-4-fluorobenzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(cc1C)Br

STL040498
Synonyms: 2-{[4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(3,4-dichlorophenyl)ethylidene]acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C(/c2ccc(c(c2)Cl)Cl)\C)nnc1c1ccc(cc1)OC

STL040499
Synonyms: (4E)-5-[3-(benzyloxy)phenyl]-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C\1/C(c2cccc(c2)OCc2ccccc2)N(C(=O)C1=O)c1nnc(s1)SCc1ccccc1Cl)/O

STL040500
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-2'-(2-methyl-3-nitrophenyl)-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: Clc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1C)[N+](=O)[O-]

STL040502
Synonyms: 4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylammonio)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-2,6-di-tert-butylphenolate
Smiles: C[NH+](Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(c(c(c1)C(C)(C)C)[O-])C(C)(C)C)C

STL040504
Synonyms: 2'-(2,4-dichlorophenyl)-8'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(c(c1)Cl)C1C(C(=O)c2ccccc2)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cc(C)cc1

STL040506
Synonyms: butyl4-{[(3Z)-3-{[(3-methylphenyl)sulfonyl]imino}-3,4-dihydroquinoxalin-2-yl]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)C

STL040507
Synonyms: 7'-chloro-2'-[(3-methoxyphenyl)carbonyl]-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)C1C(C(=O)c2ccccc2)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl

STL040508
Synonyms: N,N-dibenzyl-3-bromo-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(c1Br)NC(CC2C(F)(F)F)c1ccccc1)N(Cc1ccccc1)Cc1ccccc1

STL040509
Synonyms: N'-{(E)-[4-(benzyloxy)phenyl]methylidene}-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)N/N=C/c1ccc(cc1)OCc1ccccc1

STL040510
Synonyms: methyl[(2E)-5-(2-phenylethyl)-1,3,4-thiadiazol-2(3H)-ylidene]carbamate
Smiles: COC(=O)/N=c/1\[nH]nc(s1)CCc1ccccc1

STL040511
Synonyms: 1-(3,4-dihydroxyphenyl)-2-[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Smiles: CCn1c(SCC(=O)c2ccc(c(c2)O)O)nnc1c1ccccc1

STL040512
Synonyms: 1'-[(2-chlorophenyl)carbonyl]-2'-[(4-propylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: CCCc1ccc(cc1)C(=O)C1C(C(=O)c2ccccc2Cl)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STL040513
Synonyms: (4E)-5-(4-tert-butylphenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)c1nc2c(s1)cc(cc2)Cl)/O

STL040514
Synonyms: N-(2,5-dimethylphenyl)-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2C)nnc1c1cccc(c1)C

STL040518
Synonyms: N-[4-bromo-2-(phenylcarbonyl)phenyl]-N-(2-chlorobenzyl)-4-methylbenzenesulfonamide
Smiles: Brc1ccc(c(c1)C(=O)c1ccccc1)N(S(=O)(=O)c1ccc(cc1)C)Cc1ccccc1Cl

STL040520
Synonyms: N-[(2Z)-5-[3-(2,4-dichlorophenoxy)propyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)/N=c\1/[nH]nc(s1)CCCOc1ccc(cc1Cl)Cl

STL040521
Synonyms: 7-(4-methoxyphenyl)-2-methyl-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1C2=C(Nc3n1ncn3)c1c(OC2)ccc(c1)C

STL040522
Synonyms: 2-(4-methoxy-3-nitrophenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Smiles: COc1ccc(cc1[N+](=O)[O-])c1nc(O)c2c(n1)sc1c2CCCC1

STL040523
Synonyms: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)OCC)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

STL040524
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-ethoxy-4-(pentyloxy)phenyl]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STL040525
Synonyms: N-[(2Z)-3-[(4-ethoxyphenyl)amino]quinoxalin-2(1H)-ylidene]-4-methoxybenzenesulfonamide
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)OC

STL040527
Synonyms: N-[(2Z)-3-[(4-acetylphenyl)amino]quinoxalin-2(1H)-ylidene]-3-methylbenzenesulfonamide
Smiles: Cc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(cc1)C(=O)C

STL040528
Synonyms: 2-methoxy-4-[5-(2-methylphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl4-fluorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)F)C1N(OC2C1C(=O)N(C2=O)c1ccccc1C)c1ccccc1

STL040529
Synonyms: 7-[3-(1,3-benzoxazol-2-ylsulfanyl)propyl]-8-[benzyl(methyl)amino]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CN(c1nc2c(n1CCCSc1nc3c(o1)cccc3)c(O)nc(=O)n2C)Cc1ccccc1

STL040530
Synonyms: N-(4-butylphenyl)-2-{[5-(2-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)CCCC)nnc1c1ccccc1Cl

STL040531
Synonyms: 1-{2-oxo-2-[phenyl(propan-2-yl)amino]ethyl}-3-phenyl-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: CC(N(C(=O)Cn1cc([n+]2c1CCC2)c1ccccc1)c1ccccc1)C

STL040532
Synonyms: (5Z)-6-hydroxy-3-(4-methoxyphenyl)-5-{1-[(2-phenylethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(/NCCc2ccccc2)\C)/C1=O)O

STL040534
Synonyms: 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1OC)/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2

STL040535
Synonyms: N-(4-bromophenyl)-N'-[(2E)-5-(trifluoromethyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Smiles: O=C(Nc1ccc(cc1)Br)CCC(=O)/N=c/1\[nH]nc(s1)C(F)(F)F

STL040536
Synonyms: 2-methoxy-3-[(4-methylphenyl)amino]naphthalene-1,4-dione
Smiles: COC1=C(Nc2ccc(cc2)C)C(=O)c2c(C1=O)cccc2

STL040537
Synonyms: 7-benzyl-6-hydroxy-8-[(3-methoxypropyl)amino]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COCCCNc1nc2c(n1Cc1ccccc1)c(O)nc(=O)n2C

STL040538
Synonyms: (5E)-6-hydroxy-3-phenyl-5-{1-[(1-phenylethyl)amino]propylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1)O)/NC(c1ccccc1)C

STL040539
Synonyms: (4E)-1-benzyl-5-(3-butoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1

STL040540
Synonyms: (5Z)-2-[4-(4-nitrophenyl)piperazin-1-yl]-5-[2-(prop-2-en-1-yloxy)benzylidene]-1,3-thiazol-4(5H)-one
Smiles: C=CCOc1ccccc1/C=C/1\SC(=NC1=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STL040541
Synonyms: (5E)-3-(3-chloro-4-methylphenyl)-5-(2,5-dimethoxybenzylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(c(c1)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(c(c1)Cl)C)O)OC

STL040542
Synonyms: 4-{(Z)-[2-(3,4-dimethoxybenzyl)-5-iminio-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}-2-hydroxyphenolate
Smiles: COc1cc(ccc1OC)Cc1nn2c(=NC(=O)/C(=C\c3ccc(c(c3)O)[O-])/C2=[NH2+])s1

STL040543
Synonyms: ethyl({(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)(phenyl)acetate
Smiles: CCOC(=O)C(c1ccccc1)Oc1ccc2c(c1)O/C(=C\c1sccc1C)/C2=O

STL040544
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)OCc1ccccc1

STL040545
Synonyms: (4E)-4-[(4-bromophenyl)(hydroxy)methylidene]-5-phenyl-1-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1ccccn1)/O

STL040546
Synonyms: 3-(4-chlorophenyl)-1-[2-(naphthalen-1-yl)-2-oxoethyl]-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: Clc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)c1cccc2c1cccc2

STL040547
Synonyms: (4E)-1-benzyl-5-(3-bromophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: Brc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1

STL040549
Synonyms: (E)-(4-butoxyphenyl){1-[2-(diethylammonio)ethyl]-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)O)CC[NH+](CC)CC)/[O-]

STL040550
Synonyms: {4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}[3-methyl-1-(2-methylphenyl)-1H-thieno[2,3-c]pyrazol-5-yl]methanone
Smiles: Brc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1cc2c(s1)n(nc2C)c1ccccc1C

STL040551
Synonyms: N-[1-(4-chlorophenyl)-4-hydroxy-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)NC1(C(=O)Nc2c1c(O)nc(=O)n2c1ccc(cc1)Cl)C(F)(F)F

STL040552
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(4-chloro-3-nitrophenyl)-5-methyl-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: Cc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STL040553
Synonyms: 3,4,5-trimethoxy-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-propylbenzamide
Smiles: CCCN(C(=O)c1cc(OC)c(c(c1)OC)OC)Cc1cc2ccc(cc2[nH]c1=O)C

STL040554
Synonyms: N-(4-butylphenyl)-2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccc(cc1)C(C)(C)C

STL040555
Synonyms: 4-({[4-ammonio-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzoate
Smiles: COc1ccc(cc1)c1nnc(n1[NH3+])SCc1ccc(cc1)C(=O)[O-]

STL040556
Synonyms: 3,4,5-trimethoxy-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)/N=c\1/[nH]nc(s1)C

STL040557
Synonyms: 1'-[(4-methoxyphenyl)carbonyl]-5'-methyl-2'-[(4-propylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: CCCc1ccc(cc1)C(=O)C1C(C(=O)c2ccc(cc2)OC)N2C(C31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C

STL040558
Synonyms: 1-(2-chlorobenzyl)-3-(3,4-dichlorophenyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: Clc1cc(ccc1Cl)c1cn(c2[n+]1CCC2)Cc1ccccc1Cl

STL040559
Synonyms: N-(4-methylbenzyl)-1-[2-(morpholin-4-yl)ethyl]-1H-benzimidazol-2-amine
Smiles: Cc1ccc(cc1)CNc1nc2c(n1CCN1CCOCC1)cccc2

STL040560
Synonyms: 4-{[(E)-(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1cc(/C=N/n2c(=S)[nH]nc2c2ccccn2)c(c(c1)Br)O

STL040561
Synonyms: (1'R,2'R)-2'-(4-fluorophenyl)-1'-[(4-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Fc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccc(cc2)[N+](=O)[O-])N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STL040562
Synonyms: 1'-[(4-chlorophenyl)carbonyl]-7'-fluoro-2'-(4-fluorophenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Fc1ccc(cc1)C1C(C(=O)c2ccc(cc2)Cl)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)F

STL040563
Synonyms: (E)-{2-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: COc1cc(cc(c1O)Br)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

STL040566
Synonyms: (5E)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]propylidene}-3-butyl-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCCCN1C(=O)N=C(/C(=C(\NCc2ccc3c(c2)OCO3)/CC)/C1=O)O

STL040567
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-fluorophenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)F)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O

STL040568
Synonyms: 6-amino-4-(4-ethoxyphenyl)-3-(4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCOc1ccc(cc1)c1[nH]nc2c1C(c1ccc(cc1)OCC)C(=C(O2)N)C#N

STL040569
Synonyms: 3-tert-butyl-7-(3-chloro-4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Cc1ccc(cc1Cl)n1ncc2c1ncn1c2nnc1C(C)(C)C

STL040570
Synonyms: 3-(4-bromophenyl)-1-[2-(4-methoxyphenyl)-2-oxoethyl]-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: COc1ccc(cc1)C(=O)Cn1cc([n+]2c1CCC2)c1ccc(cc1)Br

STL040571
Synonyms: (2Z)-2-[(3-fluorophenyl)imino]-N~6~-(furan-2-ylmethyl)-5-nitro-1,2-dihydropyrimidine-4,6-diamine
Smiles: Fc1cccc(c1)/N=c/1\nc(N)c(c([nH]1)NCc1ccco1)[N+](=O)[O-]

STL040572
Synonyms: 2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1CC)c1cccc(c1)Cl

STL040573
Synonyms: 6-hydroxy-3,7-dimethyl-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/Nc1nc2c(n1C)c(O)nc(=O)n2C

STL040574
Synonyms: (5E)-5-{1-[(3,3-diphenylpropyl)amino]propylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: CC/C(=C\1/C(=NC(=NC1=O)O)O)/NCCC(c1ccccc1)c1ccccc1

STL040575
Synonyms: 5-{5-[(2,5-dimethylbenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}pentan-1-amine
Smiles: NCCCCCc1nnc(o1)SCc1cc(C)ccc1C

STL040576
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(3-nitrophenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c(c1=O)cccc2

STL040577
Synonyms: 4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1ccccn1)[N+](=O)[O-]

STL040578
Synonyms: 4-methyl-N-[(4E)-2-phenyl[1]benzofuro[3,2-d]pyrimidin-4(3H)-ylidene]aniline
Smiles: Cc1ccc(cc1)/N=c\1/[nH]c(nc2c1oc1c2cccc1)c1ccccc1

STL040579
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CC[NH+](C)C)/[O-])C

STL040580
Synonyms: 4-bromo-2-{(E)-[2-({4-[(4-bromophenyl)sulfonyl]piperazin-1-ium-1-yl}acetyl)hydrazinylidene]methyl}phenolate
Smiles: Brc1ccc(cc1)S(=O)(=O)N1CC[NH+](CC1)CC(=O)N/N=C/c1cc(Br)ccc1[O-]

STL040582
Synonyms: 2-{[(2E)-6-ethoxy-4-methylquinazolin-2(1H)-ylidene]amino}-7-(4-methylphenyl)-7,8-dihydroquinazolin-5(6H)-one
Smiles: CCOc1ccc2c(c1)c(C)n/c(=N/c1ncc3c(n1)CC(CC3=O)c1ccc(cc1)C)/[nH]2

STL040583
Synonyms: 2-{[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl}-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]acetamide
Smiles: N#CC1=C(SCC(=O)/N=c\2/sc3c([nH]2)cccc3)NC(=C(C1c1ccc(cc1)Cl)C(=O)C)C

STL040584
Synonyms: 6-(4-benzylpiperidin-1-yl)-5-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CCOCCCN1C(=S)S/C(=C\c2c(N3CCC(CC3)Cc3ccccc3)n(C)c(=O)c(c2C)C#N)/C1=O

STL040585
Synonyms: 2-methoxy-N-[(3E)-7-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: COc1ccccc1C(=O)/N=c\1/[nH]n(c2c1cc1ccc(cc1n2)C)CC(C)C

STL040586
Synonyms: (4E)-5-(3-chlorophenyl)-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)c1nnc(s1)SCc1ccc(cc1)F)/O

STL040587
Synonyms: N-(2-tert-butylphenyl)-2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1ccc(cc1)Cl

STL040588
Synonyms: 4-hydroxy-1-methyl-9-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purin-2(1H)-one
Smiles: Oc1nc(=O)n(c2c1n1CCCN(c1n2)CCc1ccccc1)C

STL040590
Synonyms: N-[(2Z)-5-(furan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)/N=c\1/[nH]nc(s1)c1ccco1

STL040591
Synonyms: 2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc3c2cccc3)nnc1c1cccc(c1)Cl

STL040592
Synonyms: 4-tert-butyl-N-[(2Z)-5-[(E)-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: COc1ccc(cc1)/C=C/c1n[nH]/c(=N/C(=O)c2ccc(cc2)C(C)(C)C)/s1

STL040593
Synonyms: 9-cyclohexyl-4-hydroxy-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purin-2(1H)-one
Smiles: Oc1nc(=O)n(c2c1n1CCCN(c1n2)C1CCCCC1)C

STL040594
Synonyms: 2,4-dimethyl-N-[(2Z)-3-{[4-(trifluoromethoxy)phenyl]amino}quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Cc1ccc(c(c1)C)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(cc1)OC(F)(F)F

STL040596
Synonyms: 7-(4-fluorophenyl)-2-(3-nitrophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Fc1ccc(cc1)n1ncc2c1ncn1c2nc(n1)c1cccc(c1)[N+](=O)[O-]

STL040597
Synonyms: 2-amino-4-(3-bromophenyl)-4H-[1]benzothieno[3,2-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)Br)sc1c2cccc1

STL040598
Synonyms: 5-chloro-2'-(3-chloro-2-methylphenyl)-7-methyl-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: Clc1cc(C)c2c(c1)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1cccc(c1C)Cl

STL040599
Synonyms: (5E)-5-(1-{[3-(dimethylamino)propyl]amino}ethylidene)-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCCCN(C)C)/C)/C1=O)O

STL040600
Synonyms: (5Z)-3-(3,5-dimethylphenyl)-5-{[(4-ethoxyphenyl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)c1cc(C)cc(c1)C)O

STL040601
Synonyms: 2-methoxy-6-{4-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]quinazolin-2-yl}phenol
Smiles: C=CCc1ccc(c(c1)OC)Oc1nc(nc2c1cccc2)c1cccc(c1O)OC

STL040602
Synonyms: N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]pyridine-2-carboxamide
Smiles: COc1ccc(cc1)N(C(=O)c1ccccn1)Cc1cc2ccc(cc2[nH]c1=O)C

STL040603
Synonyms: methylN-[(4-phenoxyphenyl)carbamoyl]methioninate
Smiles: COC(=O)C(NC(=O)Nc1ccc(cc1)Oc1ccccc1)CCSC

STL040604
Synonyms: (5Z)-1-methyl-5-{[5-(pyrrolidin-1-yl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=NC(=O)/C(=C/c2ccc(o2)N2CCCC2)/C1=O)S

STL040605
Synonyms: 2-(5-{(E)-[1-(4-chlorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-2,4-dimethoxybenzyl)-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc(OC)c(cc1/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)CN1C(=O)c2c(C1=O)cccc2

STL040606
Synonyms: (4E)-5-(4-hydroxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Oc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1noc(c1)C

STL040607
Synonyms: N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-N'-(1,2,3,4-tetrahydronaphthalen-1-yl)butanediamide
Smiles: CCc1n[nH]/c(=N/C(=O)CCC(=O)NC2CCCc3c2cccc3)/s1

STL040608
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CCCn1c[nH+]cc1)/[O-]

STL040609
Synonyms: ethyl{(5E)-5-[(phenylacetyl)imino]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetate
Smiles: CCOC(=O)Cc1n[nH]/c(=N\C(=O)Cc2ccccc2)/s1

STL040611
Synonyms: 4-chloro-N-[(4E)-2-methyl[1]benzofuro[3,2-d]pyrimidin-4(3H)-ylidene]aniline
Smiles: Clc1ccc(cc1)/N=c\1/[nH]c(C)nc2c1oc1c2cccc1

STL040612
Synonyms: 2-methyl-N-(3-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]propanamide
Smiles: Cc1cccc(c1)N(C(=O)C(C)C)Cc1cc2ccccc2[nH]c1=O

STL040613
Synonyms: (5E)-3-benzyl-5-{[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: OCC(N/C=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)(CO)C

STL040614
Synonyms: {(6Z)-4-amino-6-[(2-methoxyphenyl)imino]-1,6-dihydro-1,3,5-triazin-2-yl}methylmorpholine-4-carbodithioate
Smiles: COc1ccccc1/N=c/1\nc(N)nc([nH]1)CSC(=S)N1CCOCC1

STL040615
Synonyms: (2E)-2-cyano-N-(3,5-dimethylphenyl)-2-[(5E)-5-(3-nitrobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2cccc(c2)[N+](=O)[O-])/c(=O)n1c1ccccc1)/C(=O)Nc1cc(C)cc(c1)C

STL040616
Synonyms: 2'-[(4-bromophenyl)carbonyl]-1'-[(2-fluorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Brc1ccc(cc1)C(=O)C1C(C(=O)c2ccccc2F)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STL040617
Synonyms: (3S,3a'R,8a'S,8b'S)-5-methoxy-2'-(2-methyl-5-nitrophenyl)-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: COc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-]

STL040618
Synonyms: 2-{[5-(2-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1c1ccccc1OC

STL040619
Synonyms: (E)-[4-(benzyloxy)phenyl][2-(4-hydroxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: Oc1ccc(cc1)C1N(Cc2ccc[nH+]c2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1ccccc1)/[O-]

STL040620
Synonyms: N-[(2Z)-3-[(3-chloro-4-fluorophenyl)amino]quinoxalin-2(1H)-ylidene]-4-fluorobenzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(c(c1)Cl)F

STL040621
Synonyms: methyl2-[(3E)-3-[(4-butoxy-3-methylphenyl)(hydroxy)methylidene]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)c1nc(c(s1)C(=O)OC)C)/O

STL040622
Synonyms: 1-cyclopropyl-6-fluoro-8-methoxy-7-{4-[(1-methoxy-1-oxopropan-2-yl)carbamothioyl]-3-methylpiperazin-1-yl}-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: COC(=O)C(NC(=S)N1CCN(CC1C)c1c(F)cc2c(c1OC)n(cc(c2=O)C(=O)O)C1CC1)C

STL040623
Synonyms: methylN-[(2-ethylphenyl)carbamoyl]-D-alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1CC)C

STL040624
Synonyms: N'-{(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}-2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nc3ccccc3c(=O)n2c2ccc(cc2)Cl)ccc1OCc1ccccc1

STL040625
Synonyms: methylN-{[4-(trifluoromethoxy)phenyl]carbamoyl}alaninate
Smiles: COC(=O)C(NC(=O)Nc1ccc(cc1)OC(F)(F)F)C

STL040626
Synonyms: 3,4-dimethoxy-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: COc1cc(ccc1OC)C(=O)/N=c\1/[nH]nc(s1)C(C)C

STL040627
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-propyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-bromo-6-methoxyphenolate
Smiles: CCCc1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1cc(Br)c(c(c1)OC)[O-]

STL040628
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1COc1ccc(cc1)Cl

STL040629
Synonyms: N-[(3Z)-1-butyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-3-nitrobenzamide
Smiles: CCCCn1[nH]/c(=N\C(=O)c2cccc(c2)[N+](=O)[O-])/c2c1nc1c(C)cccc1c2

STL040631
Synonyms: 1-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,3-dimethylbutan-2-one
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)C(C)(C)C

STL040632
Synonyms: N-[(2Z)-3-{[2-(cyclohex-1-en-1-yl)ethyl]amino}quinoxalin-2(1H)-ylidene]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCCC1=CCCCC1

STL040635
Synonyms: {4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenoxy}acetate
Smiles: [O-]C(=O)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1[NH3+]

STL040636
Synonyms: N-[(3Z)-1,6-dimethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: Cc1ccc2c(c1)cc1c(n2)n([nH]/c/1=N\C(=O)c1ccccc1)C

STL040637
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nnc1c1ccc(cc1)OC

STL040638
Synonyms: 2-hydroxy-N'-{(1Z)-1-[4-hydroxy-2,6-dioxo-1-(prop-2-en-1-yl)-1,6-dihydropyrimidin-5(2H)-ylidene]ethyl}benzohydrazide
Smiles: C=CCN1C(=O)N=C(/C(=C(/NNC(=O)c2ccccc2O)\C)/C1=O)O

STL040639
Synonyms: 8-(azepan-1-yl)-6-hydroxy-3-methyl-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-2H-purin-2-one
Smiles: Oc1nc(=O)n(c2c1n(CCSc1ncccn1)c(n2)N1CCCCCC1)C

STL040640
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STL040641
Synonyms: 4-(4-bromophenyl)-1-(4-methylphenyl)-3-phenyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2c(C(SC1)c1ccc(cc1)Br)c(nn2c1ccc(cc1)C)c1ccccc1

STL040643
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(2,3-dimethoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1c(OC)cccc1C1N(c2noc(c2)C)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/O

STL040645
Synonyms: 1-benzyl-2-{[(4-methylphenyl)sulfonyl]amino}-N-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1n(Cc2ccccc2)c2c(c1C(=O)NCCc1ccccc1)nc1c(n2)cccc1

STL040646
Synonyms: N-[(3Z)-1-butyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]butanamide
Smiles: CCCCn1[nH]/c(=N\C(=O)CCC)/c2c1nc1c(C)cccc1c2

STL040647
Synonyms: N-[(2Z)-3-[(4-bromo-3-methylphenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Brc1ccc(cc1C)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccccc1

STL040648
Synonyms: 4-(3,4-dichlorophenyl)-N-(3-methoxyphenyl)-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)OC)n2c3c1CCCCn3c(c2)c1ccc(c(c1)Cl)Cl

STL040649
Synonyms: 3-(3,4-dichlorophenyl)-1-{2-[(2-methoxyphenyl)amino]-2-oxoethyl}-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: COc1ccccc1NC(=O)Cn1cc([n+]2c1CCC2)c1ccc(c(c1)Cl)Cl

STL040650
Synonyms: 6-hydroxy-8-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3-methyl-7-(propan-2-yl)-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c(n1C(C)C)c(O)nc(=O)n2C

STL040651
Synonyms: (4E)-5-(4-chlorophenyl)-1-hexadecyl-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)Cl

STL040652
Synonyms: 5''-methyl-2'-[(3-nitrophenyl)carbonyl]-5',6',7',7a'-tetrahydrodispiro[indole-3,1'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Cc1ccc2c(c1)C1(C(=O)N2)N2CCCC2C2(C1C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)Nc1c2cccc1

STL040654
Synonyms: N-[(2Z)-5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-phenylbutanamide
Smiles: CCC(C(=O)/N=c\1/[nH]nc(s1)Cc1ccc(c(c1)OC)OC)c1ccccc1

STL040656
Synonyms: N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-(4-fluorophenoxy)acetamide
Smiles: CCc1n[nH]/c(=N/C(=O)COc2ccc(cc2)F)/s1

STL040657
Synonyms: 3-(2,4-dichlorophenyl)-5-(naphthalen-2-yl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Clc1ccc(c(c1)Cl)C1N(OC2C1C(=O)N(C2=O)c1ccc2c(c1)cccc2)c1cccc(c1)[N+](=O)[O-]

STL040659
Synonyms: (4E)-5-(3-ethoxyphenyl)-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

STL040660
Synonyms: 2-phenyl-N-(tetrahydrofuran-2-ylmethyl)[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: c1ccc(cc1)c1nc(NCC2CCCO2)c2c(n1)c1ccccc1o2

STL040661
Synonyms: 3-(4-methylphenyl)-1-{2-oxo-2-[phenyl(propan-2-yl)amino]ethyl}-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: Cc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)N(c1ccccc1)C(C)C

STL040662
Synonyms: 3-ethyl7-methyl8-methyl-1-(2-nitrophenyl)-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)SC(=C(N2c1ccccc1)C)C(=O)OC)c1ccccc1[N+](=O)[O-]

STL040663
Synonyms: N-[(2E)-6-fluoro-1,3-benzothiazol-2(3H)-ylidene]-5-nitrofuran-2-carboxamide
Smiles: Fc1ccc2c(c1)s/c(=N/C(=O)c1ccc(o1)[N+](=O)[O-])/[nH]2

STL040664
Synonyms: 1-ammonionaphthalen-2-olate
Smiles: [O-]c1ccc2c(c1[NH3+])cccc2

STL040665
Synonyms: 2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccccc1F

STL040667
Synonyms: 3-methoxy-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(propan-2-yl)benzamide
Smiles: COc1cccc(c1)C(=O)N(C(C)C)Cc1cc2cc(C)ccc2[nH]c1=O

STL040668
Synonyms: 1-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)OC)c1ccc(c(c1)C)C

STL040670
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(5-methylfuran-2-yl)-4,5-dioxopyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)CCCn1c[nH+]cc1)/[O-]

STL040671
Synonyms: diethyl8-methyl-1-(4-nitrophenyl)-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)SC(=C(N2c1ccccc1)C)C(=O)OCC)c1ccc(cc1)[N+](=O)[O-]

STL040673
Synonyms: 6-amino-3-(3-methoxyphenyl)-4-(4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCOc1ccc(cc1)C1C(=C(N)Oc2c1c([nH]n2)c1cccc(c1)OC)C#N

STL040674
Synonyms: (5Z)-1-(3-chlorophenyl)-4,6-dioxo-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolinium-9-ylmethylidene)-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: Clc1cccc(c1)N1C(=NC(=O)/C(=C/c2cc3CCC[NH+]4c3c(c2)CCC4)/C1=O)[S-]

STL040675
Synonyms: 8-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-6-hydroxy-3,7-dimethyl-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccccc1/C=N/Nc1nc2c(n1C)c(O)nc(=O)n2C

STL040676
Synonyms: (5E)-5-(1-{[2-(cyclohex-1-en-1-yl)ethyl]amino}ethylidene)-6-hydroxy-3-phenylpyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(\NCCC2=CCCCC2)/C)/C(=O)N1c1ccccc1

STL040677
Synonyms: methyl5-(3-nitrophenyl)-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])N=O

STL040678
Synonyms: 6-amino-4-(4-hydroxy-3-methoxyphenyl)-3-(4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCOc1ccc(cc1)c1[nH]nc2c1C(c1ccc(c(c1)OC)O)C(=C(O2)N)C#N

STL040679
Synonyms: 4-[(E)-[2-(4-ethoxy-3-methoxyphenyl)-1-(2-methoxyethyl)-4,5-dioxopyrrolidin-3-ylidene](hydroxy)methyl]-N,N-dimethylbenzenesulfonamide
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)S(=O)(=O)N(C)C)/O)/C1c1ccc(c(c1)OC)OCC

STL040680
Synonyms: (5Z)-5-{[(2,5-dimethoxyphenyl)amino]methylidene}-3-(3,5-dimethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1N/C=C\1/C(=NC(=O)N(C1=O)c1cc(C)cc(c1)C)O)OC

STL040681
Synonyms: (5Z)-5-(1-{2-[2-(diethylammonio)ethyl]hydrazinyl}ethylidene)-2-hydroxy-6-oxo-5,6-dihydropyrimidin-4-olate
Smiles: CC[NH+](CCNN/C(=C\1/C(=NC(=NC1=O)O)[O-])/C)CC

STL040682
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-2-sulfanyl-1-[3-(trifluoromethyl)phenyl]pyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCCN2Cc1ccccc1)c1cccc(c1)C(F)(F)F

STL040683
Synonyms: (5Z)-6-hydroxy-3-(4-methylphenyl)-5-{1-[(2-phenylethyl)amino]propylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/NCCc1ccccc1

STL040684
Synonyms: 7-chloro-1-(4-nitrophenyl)-2-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1ccccn1

STL040685
Synonyms: 1-(4-chlorophenyl)-4-hydroxy-7-methyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Smiles: Clc1ccc(cc1)n1c(=O)nc(c2c1NC(=NC2(C(F)(F)F)C(F)(F)F)C)O

STL040686
Synonyms: 3-(4-chlorophenyl)-1-(3,3-dimethyl-2-oxobutyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: Clc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)C(C)(C)C

STL040687
Synonyms: 3-(2-chloro-6-fluorophenyl)-5-(2,4-dimethylphenyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)[N+](=O)[O-])c1c(F)cccc1Cl

STL040689
Synonyms: (5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-6-hydroxy-3-(3-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C1=O)O

STL040690
Synonyms: N-[(4Z)-[1]benzofuro[3,2-d]pyrimidin-4(3H)-ylidene]aniline
Smiles: c1ccc(cc1)/N=c/1\[nH]cnc2c1oc1c2cccc1

STL040691
Synonyms: 4-hydroxy-7-(3-methoxyphenyl)-1-(4-methylphenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Smiles: COc1cccc(c1)C1=NC(c2c(N1)n(c1ccc(cc1)C)c(=O)nc2O)(C(F)(F)F)C(F)(F)F

STL040692
Synonyms: N-[(2Z)-5-[(E)-2-(4-chlorophenyl)ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3,4,5-triethoxybenzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c\1/[nH]nc(s1)/C=C/c1ccc(cc1)Cl

STL040693
Synonyms: (E)-{2-(3,4-dichlorophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(dimethylsulfamoyl)phenyl]methanolate
Smiles: C[NH+](CCCN1C(c2ccc(c(c2)Cl)Cl)/C(=C(/c2ccc(cc2)S(=O)(=O)N(C)C)\[O-])/C(=O)C1=O)C

STL040694
Synonyms: 2,4-dichloro-N-[(2E)-5-(pyridin-3-yl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)/N=c/1\[nH]nc(s1)c1cccnc1

STL040695
Synonyms: 3'-(4-hydroxybenzyl)-5'-(2-methyl-4-nitrophenyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Oc1ccc(cc1)CC1NC2(C3C1C(=O)N(C3=O)c1ccc(cc1C)[N+](=O)[O-])C(=O)Nc1c2cccc1

STL040696
Synonyms: 4-[(Z)-{2-[4-(4-fluorophenyl)piperazin-4-ium-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]-2-methoxyphenolate
Smiles: COc1cc(ccc1[O-])/C=C/1\SC(=NC1=O)N1CC[NH+](CC1)c1ccc(cc1)F

STL040697
Synonyms: N-[(3Z)-1-butyl-6-methoxy-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-nitrobenzamide
Smiles: CCCCn1[nH]/c(=N\C(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1ccc(cc1c2)OC

STL040698
Synonyms: (5E)-5-{1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]ethylidene}-6-hydroxy-3-phenylpyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C(/Nc1c(=O)n(n(c1C)C)c1ccccc1)\C)c1ccccc1

STL040699
Synonyms: N-[(2Z)-3-[(3-acetylphenyl)amino]quinoxalin-2(1H)-ylidene]-2,5-dimethylbenzenesulfonamide
Smiles: Cc1ccc(c(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1cccc(c1)C(=O)C)C

STL040701
Synonyms: 4-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)-5-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1)c1[nH]nc2c1C(c1ccc(c(c1)OC)OC)N(C2=O)c1ccccc1

STL040702
Synonyms: (4E)-4-[furan-2-yl(hydroxy)methylidene]-1-[2-(2-hydroxyethoxy)ethyl]-5-[4-hydroxy-3-(methoxymethyl)phenyl]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(c(c1)COC)O

STL040703
Synonyms: 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-5-(naphthalen-1-yl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCOc1cc(cc(c1O)Br)C1N(OC2C1C(=O)N(C2=O)c1cccc2c1cccc2)c1ccccc1

STL040704
Synonyms: butyl[4-(dimethylamino)phenyl][hydroxy(2-methoxyphenyl)methyl]phosphinate
Smiles: CCCCOP(=O)(C(c1ccccc1OC)O)c1ccc(cc1)N(C)C

STL040705
Synonyms: (5Z)-5-[(5-bromo-1H-indol-3-yl)methylidene]-1-(4-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)N1C(=NC(=O)/C(=C/c2c[nH]c3c2cc(Br)cc3)/C1=O)S

STL040706
Synonyms: N,N'-(pentane-1,5-diyldi-1,3,4-thiadiazol-2-yl-5-ylidene)bis(2-methylpropanamide)
Smiles: CC(C(=O)/N=c/1\[nH]nc(s1)CCCCCc1n[nH]/c(=N/C(=O)C(C)C)/s1)C

STL040708
Synonyms: 1-(3,4-dichlorophenyl)-2-{[4-methyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: O=C(c1ccc(c(c1)Cl)Cl)CSc1nnc(n1C)c1ccccn1

STL040709
Synonyms: (5E)-3-(4-chlorophenyl)-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O

STL040710
Synonyms: N-(2-bromophenyl)-2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2Br)nnc1c1ccccc1Cl

STL040712
Synonyms: 5-(2-chloro-5-nitrophenyl)-2-(3,4-dimethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc(cc1OC)C1=NN2C(C1)c1ccccc1OC2c1cc(ccc1Cl)[N+](=O)[O-]

STL040713
Synonyms: 6-amino-4-(2,5-dimethoxyphenyl)-3-(3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: COc1ccc(c(c1)C1C(=C(N)Oc2c1c([nH]n2)c1cccc(c1)OC)C#N)OC

STL040714
Synonyms: (5E)-1-(2,5-dimethoxyphenyl)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(cc1N1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)CC)/C1=O)S)OC

STL040716
Synonyms: propan-2-yl{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Smiles: COc1ccccc1c1nnc(n1CC)SCC(=O)OC(C)C

STL040717
Synonyms: (5E)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-6-hydroxy-3-(1-phenylethyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)C(c1ccccc1)C)O

STL040718
Synonyms: (6aS,6bR,9aS,10R)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(3-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc(c1)[N+](=O)[O-])C=Cc1c2cccc1

STL040719
Synonyms: 3,6-dichloro-N-[(2E)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]-1-benzothiophene-2-carboxamide
Smiles: COc1ccc2c(c1)s/c(=N/C(=O)c1sc3c(c1Cl)ccc(c3)Cl)/[nH]2

STL040720
Synonyms: (5E)-3-(3-fluorophenyl)-6-hydroxy-5-{[1-(propan-2-yl)-1H-indol-3-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: Fc1cccc(c1)N1C(=O)N=C(/C(=C\c2cn(c3c2cccc3)C(C)C)/C1=O)O

STL040721
Synonyms: 2,5-dichloro-N-[(2Z)-3-(cyclohexylamino)quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Clc1ccc(c(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NC1CCCCC1)Cl

STL040722
Synonyms: N-[4-(diethylamino)phenyl]-N'-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Smiles: CCCc1n[nH]/c(=N\C(=O)CCC(=O)Nc2ccc(cc2)N(CC)CC)/s1

STL040723
Synonyms: 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: O=C1C2N(N=C(C2C(=O)N1c1cccc(c1C)Cl)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STL040725
Synonyms: N-[(3Z)-1,7-dimethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]cyclohexanecarboxamide
Smiles: Cc1ccc2c(c1)nc1c(c2)/c(=N/C(=O)C2CCCCC2)/[nH]n1C

STL040727
Synonyms: (5E)-3-(4-chlorophenyl)-5-(1-{[4-(diethylamino)phenyl]amino}ethylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCN(c1ccc(cc1)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/C)CC

STL040729
Synonyms: 2-[(6-ethoxy-4-methylquinazolin-2-yl)amino]-6-methyl-5-pentylpyrimidin-4-ol
Smiles: CCCCCc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)ccc(c2)OCC

STL040730
Synonyms: 1-(3,4-dihydroxyphenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Cc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)c1ccc(c(c1)O)O

STL040731
Synonyms: (4E)-5-(4-butoxy-3-ethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(furan-2-ylmethyl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccco1

STL040732
Synonyms: N-(tetrahydrofuran-2-ylmethyl)[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: C1COC(C1)CNc1ncnc2c1oc1c2cccc1

STL040734
Synonyms: N-[(2Z)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)quinoxalin-2(1H)-ylidene]-3-methylbenzenesulfonamide
Smiles: Cc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc2c(c1)OCCO2

STL040735
Synonyms: 4-[(4-chloronaphthalen-1-yl)oxy]-2-[4-(propan-2-yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(Oc2ccc(c3c2cccc3)Cl)c2c(n1)cccc2)C

STL040738
Synonyms: (5Z)-1-(3,4-dimethylphenyl)-2,6-dioxo-5-[(piperidinium-1-ylamino)methylidene]-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C/N[NH+]2CCCCC2)/C(=O)N1c1ccc(c(c1)C)C

STL040739
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-methoxyphenyl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N

STL040740
Synonyms: (2Z)-6-(4-benzylpiperazin-1-yl)-2-[(3-fluorophenyl)imino]-5-nitro-1,2-dihydropyrimidin-4-amine
Smiles: Fc1cccc(c1)/N=c/1\nc(N)c(c([nH]1)N1CCN(CC1)Cc1ccccc1)[N+](=O)[O-]

STL040741
Synonyms: 2-bromo-N-[(2E)-5-(4-methoxybenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: COc1ccc(cc1)Cc1n[nH]/c(=N\C(=O)c2ccccc2Br)/s1

STL040742
Synonyms: 3-amino-N-[(2E)-4-methyl-1,3-thiazol-2(3H)-ylidene]-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide
Smiles: Cc1cs/c(=N/C(=O)c2sc3c(c2N)c(c2c(n3)CCCCC2)C(F)(F)F)/[nH]1

STL040744
Synonyms: 5-hydroxy-2-{[2-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-4-(5-methylfuran-2-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)N2C(C)Cc3c2cccc3)N=C2C(=C(O)CCC2)C1c1ccc(o1)C

STL040745
Synonyms: 3-chloro-N-[(2Z)-3-[(2,4-dichlorophenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Clc1ccc(c(c1)Cl)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)Cl

STL040746
Synonyms: (4E)-4-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-5-(4-nitrophenyl)-1-phenylpyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1ccccc1)/C=C/c1ccccc1

STL040747
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-(3-propoxyphenyl)pyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](CC)CC

STL040749
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-(5-methylfuran-2-yl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Cc1ccc(o1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/[O-]

STL040750
Synonyms: 1-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-(4-fluorophenyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: COc1ccc(cc1NC(=O)Cn1cc([n+]2c1CCC2)c1ccc(cc1)F)OC

STL040752
Synonyms: 3-[(3-fluorobenzyl)sulfanyl]-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole
Smiles: Fc1cccc(c1)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STL040753
Synonyms: ethyl1-(3-{(Z)-[3-(4-methoxybenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)OC

STL040754
Synonyms: 1-[2-(4-ethoxyphenyl)-2-oxoethyl]-3-(4-fluorophenyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: CCOc1ccc(cc1)C(=O)Cn1cc([n+]2c1CCC2)c1ccc(cc1)F

STL040757
Synonyms: (4E)-5-(3-chlorophenyl)-4-{hydroxy[4-(piperidin-1-ylsulfonyl)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2cccc(c2)Cl)/C(=C(/c2ccc(cc2)S(=O)(=O)N2CCCCC2)\O)/C(=O)C1=O

STL040758
Synonyms: 3-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenolate
Smiles: [O-]c1cccc(c1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1[NH3+]

STL040759
Synonyms: 2-[5-(1,3-benzodioxol-5-yl)-3-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-6-chloro-4-phenylquinazoline
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1ccc2c(c1)OCO2)c1nc2ccc(cc2c(n1)c1ccccc1)Cl

STL040760
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C

STL040761
Synonyms: ethyl{[5-(1-amino-3-methylbutyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc(o1)C(CC(C)C)N

STL040762
Synonyms: (E)-{2-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: C=CCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1Cc1cc[nH+]cc1

STL040763
Synonyms: [5,10,15,20-tetraphenylporphyrinato(2-)-kappa~2~N~21~,N~23~]cobalt(1+)
Smiles: c1ccc(cc1)C1=C2C=CC(=N2)C(=c2n3[Co+]n4c1ccc4C(=C1C=CC(=N1)C(=c3cc2)c1ccccc1)c1ccccc1)c1ccccc1

STL040764
Synonyms: 4-({(E)-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C=CCc1cccc(c1O)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(C)C

STL040765
Synonyms: 3-(4-chlorophenyl)-1-[2-(4-ethylphenyl)-2-oxoethyl]-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: CCc1ccc(cc1)C(=O)Cn1cc([n+]2c1CCC2)c1ccc(cc1)Cl

STL040766
Synonyms: 8-(azepan-1-yl)-6-hydroxy-3-methyl-7-{2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Smiles: Cc1csc(n1)SCCn1c(nc2c1c(O)nc(=O)n2C)N1CCCCCC1

STL040767
Synonyms: prop-2-en-1-yl2-{(3E)-2-[4-(benzyloxy)-3-ethoxyphenyl]-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(c(c1)OCC)OCc1ccccc1

STL040769
Synonyms: 5'-(4-chloro-3-nitrophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC(C1NC2(C3C1C(=O)N(C3=O)c1ccc(c(c1)[N+](=O)[O-])Cl)C(=O)Nc1c2cccc1)C

STL040770
Synonyms: 8-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-6-hydroxy-7-(2-hydroxyethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCn1c(N/N=C/c2ccccc2Cl)nc2c1c(O)nc(=O)n2C

STL040772
Synonyms: (2E)-2-cyano-N-(4-ethoxyphenyl)-2-[(5E)-5-(4-nitrobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: CCOc1ccc(cc1)NC(=O)/C(=c\1/s/c(=C/c2ccc(cc2)[N+](=O)[O-])/c(=O)n1c1ccccc1)/C#N

STL040773
Synonyms: N-(3-chloro-4-fluorophenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)F)nnc1c1cccc(c1)C

STL040774
Synonyms: 5-chloro-2'-(3-chlorophenyl)-7-methyl-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: Clc1cccc(c1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(Cl)cc2C

STL040775
Synonyms: N-[(3Z)-1-butyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]cyclohexanecarboxamide
Smiles: CCCCn1[nH]/c(=N\C(=O)C2CCCCC2)/c2c1nc1ccccc1c2

STL040776
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chloro-6-fluorophenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)N/N=C/c1c(F)cccc1Cl

STL040777
Synonyms: (E)-(4-butoxyphenyl){1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}methanolate
Smiles: CCCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CC[NH+](CC)CC)/[O-]

STL040779
Synonyms: benzyl[(2,6-dichlorophenyl)(hydroxy)methyl][4-(dimethylamino)phenyl]phosphinate
Smiles: CN(c1ccc(cc1)P(=O)(C(c1c(Cl)cccc1Cl)O)OCc1ccccc1)C

STL040780
Synonyms: 4-[(E)-[2-(3-bromophenyl)-1-(2-methoxyethyl)-4,5-dioxopyrrolidin-3-ylidene](hydroxy)methyl]-N,N-dimethylbenzenesulfonamide
Smiles: COCCN1C(c2cccc(c2)Br)/C(=C(/c2ccc(cc2)S(=O)(=O)N(C)C)\O)/C(=O)C1=O

STL040781
Synonyms: (5E)-6-hydroxy-3-(3-methoxyphenyl)-5-[(1-propyl-1H-indol-3-yl)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: CCCn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)c1cccc(c1)OC)O

STL040782
Synonyms: 7'-chloro-1'-(2,2-dimethylpropanoyl)-2'-{[4-(2-methylpropyl)phenyl]carbonyl}-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: CC(Cc1ccc(cc1)C(=O)C1C(N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl)C(=O)C(C)(C)C)C

STL040783
Synonyms: 2-[(E)-(2-{[2-(4-ammonio-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]acetyl}hydrazinylidene)methyl]-4-nitrophenolate
Smiles: O=C(Cn1c(nc2c1cccc2)c1nonc1[NH3+])N/N=C/c1cc(ccc1[O-])[N+](=O)[O-]

STL040785
Synonyms: (5E)-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-cyclohexyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C/1\C(=O)N=C(N(C1=O)C1CCCCC1)S

STL040786
Synonyms: propyl4-{[(3Z)-3-{[(3-chlorophenyl)sulfonyl]imino}-3,4-dihydroquinoxalin-2-yl]amino}benzoate
Smiles: CCCOC(=O)c1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)Cl

STL040789
Synonyms: (3aR,6aS)-5-(3-nitrophenyl)-3-(pyridin-3-yl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1C(=NO2)c1cccnc1

STL040790
Synonyms: 3-(4-methoxyphenyl)-1-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: COc1ccc(cc1)NC(=O)Cn1cc([n+]2c1CCC2)c1ccc(cc1)OC

STL040791
Synonyms: (4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-[2-(2-hydroxyethoxy)ethyl]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC)/O)/C1c1ccc(cc1)C(C)C

STL040792
Synonyms: 2-[3-(3-chlorophenyl)-6,6-dimethyl-2,4-dioxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]-N,N-diphenylacetamide
Smiles: Clc1cccc(c1)n1c(=O)c2c3CC(C)(C)OCc3sc2n(c1=O)CC(=O)N(c1ccccc1)c1ccccc1

STL040793
Synonyms: (5E)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-1-(4-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)C)S

STL040795
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STL040796
Synonyms: 2-[4-(4-bromo-2-methylphenoxy)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Oc2ccc(cc2C)Br)c2c(n1)cccc2

STL040797
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[3-(dimethylammonio)propyl]-2-(3-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

STL040798
Synonyms: (5Z)-5-[4-(azepan-1-yl)benzylidene]-3-(2-chlorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/c2ccc(cc2)N2CCCCCC2)/C(=O)N1c1ccccc1Cl

STL040799
Synonyms: 6-amino-N'-[(E)-quinoxalin-6-ylmethylidene]hexanehydrazide
Smiles: NCCCCCC(=O)N/N=C/c1ccc2c(c1)nccn2

STL040800
Synonyms: 11-(3-bromophenyl)-N-(2,5-dimethylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Brc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cc(C)ccc1C)c1ccccc1

STL040802
Synonyms: 1'-[(4-chlorophenyl)carbonyl]-2'-[(4-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)C1C(C(=O)c2ccc(cc2)Cl)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)C

STL040803
Synonyms: {4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(thiophen-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenoxy}acetate
Smiles: [O-]C(=O)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1[NH3+]

STL040804
Synonyms: (4E)-5-(4-butoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(2-phenylethyl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCc1ccccc1

STL040806
Synonyms: (E)-{2-(3-butoxyphenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL040807
Synonyms: (E)-{2-(4-bromophenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Br)CC[NH+](C)C)/[O-])C

STL040808
Synonyms: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-[(2-phenylhydrazinyl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: SC1=NC(=O)/C(=C\NNc2ccccc2)/C(=O)N1CCC1=CCCCC1

STL040809
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-2,3-dihydro-1H-inden-1-ylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CN(c1ccccc1)C)C(=O)N/N=C/1\CCc2c1cccc2

STL040810
Synonyms: 2-[(4-nitrobenzyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCn1c(SCc2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)c1CCCCc1s2

STL040811
Synonyms: (E)-[2-(4-methoxyphenyl)-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene]{4-[(3-methylbenzyl)oxy]phenyl}methanolate
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\[O-])/C(=O)C(=O)N1Cc1cc[nH+]cc1

STL040812
Synonyms: 2,5-bis{[bis(2-chloroethyl)amino]methyl}-1,6-bis[4-(pentyloxy)phenyl]hexane-1,6-dione
Smiles: ClCCN(CC(C(=O)c1ccc(cc1)OCCCCC)CCC(C(=O)c1ccc(cc1)OCCCCC)CN(CCCl)CCCl)CCCl

STL040814
Synonyms: (4E)-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(5-methylfuran-2-yl)methylidene]-5-(pyridin-4-yl)pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)CSc1nnc(s1)N1C(c2ccncc2)/C(=C(/c2ccc(o2)C)\O)/C(=O)C1=O

STL040815
Synonyms: 6-amino-4-(2,4-dichlorophenyl)-3-(4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCOc1ccc(cc1)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1ccc(cc1Cl)Cl

STL040816
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chloro-6-nitrophenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1c(Cl)cccc1[N+](=O)[O-]

STL040817
Synonyms: (5E)-2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-5-[(5-phenylfuran-2-yl)methylidene]-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1ccc(o1)c1ccccc1)N1CCN(CC1)c1ccc(c(c1)Cl)C

STL040820
Synonyms: 2-[4-(2-chlorophenoxy)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Oc2ccccc2Cl)c2c(n1)cccc2

STL040821
Synonyms: 4-{(E)-2-[4-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]ethenyl}-2,6-diphenylpyranium
Smiles: c1ccc(cc1)C1CC(=NN1c1ccc(cc1)/C=C/c1cc([o+]c(c1)c1ccccc1)c1ccccc1)c1ccccc1

STL040822
Synonyms: 4-bromo-2-[(E)-{2-[(4-nitro-1H-pyrazol-2-ium-1-yl)acetyl]hydrazinylidene}methyl]phenolate
Smiles: O=C(Cn1[nH+]cc(c1)[N+](=O)[O-])N/N=C/c1cc(Br)ccc1[O-]

STL040823
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-2-[4-(dimethylamino)phenyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/[O-])/C1c1ccc(cc1)N(C)C)CC

STL040824
Synonyms: (5E)-5-[(azepanium-1-ylamino)methylidene]-2,6-dioxo-1-(2-phenylethyl)-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C\N[NH+]2CCCCCC2)/C(=O)N1CCc1ccccc1

STL040825
Synonyms: 2-{[4-(4-chlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)C

STL040826
Synonyms: (5E)-1-benzyl-2,6-dioxo-5-{1-[(pyridinium-3-ylmethyl)amino]propylidene}-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)[O-])/NCc1ccc[nH+]c1

STL040827
Synonyms: prop-2-en-1-yl2-[(3E)-3-{[4-(benzyloxy)-3-methylphenyl](hydroxy)methylidene}-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OCc2ccccc2)/O)/C1c1ccc(cc1)C

STL040828
Synonyms: 2-{[6-amino-2-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]amino}ethanol
Smiles: OCCNc1nc(nc(c1[N+](=O)[O-])N)N1CCN(CC1)C

STL040829
Synonyms: N-cyclohexyl-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]thiophene-2-carboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)c1cccs1)C1CCCCC1

STL040830
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2-chloro-4-nitrophenyl)-5-methyl-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: Cc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)[N+](=O)[O-]

STL040831
Synonyms: ethyl2-[(3E)-3-{[4-(benzyloxy)-3-methylphenyl](hydroxy)methylidene}-2-(4-tert-butylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccc(c(c2)C)OCc2ccccc2)\O)/C(=O)C1=O

STL040832
Synonyms: 2-amino-4-(4-chloro-3-nitrophenyl)-5-ethyl-6-propylpyridine-3-carbonitrile
Smiles: CCCc1nc(N)c(c(c1CC)c1ccc(c(c1)[N+](=O)[O-])Cl)C#N

STL040833
Synonyms: 3-(4-bromophenyl)-4-oxo-8-(pyrrolidinium-1-ylmethyl)-4H-chromen-7-olate
Smiles: Brc1ccc(cc1)c1coc2c(c1=O)ccc(c2C[NH+]1CCCC1)[O-]

STL040834
Synonyms: 4-methyl-N-[(3Z)-8-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CCCn1[nH]/c(=N\C(=O)c2ccc(cc2)C)/c2c1nc1c(c2)cccc1C

STL040835
Synonyms: 8-[4-(diphenylmethyl)piperazin-1-yl]-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(nc2N2CCOCC2)sc2c1ncnc2N1CCN(CC1)C(c1ccccc1)c1ccccc1

STL040836
Synonyms: 7,9,9-trimethyl-9a-[(E)-2-(3-nitrophenyl)ethenyl]-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: O=C1CN2C(N1)(/C=C/c1cccc(c1)[N+](=O)[O-])C(c1c2ccc(c1)C)(C)C

STL040838
Synonyms: 9-cyclohexyl-4-hydroxy-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purin-2(1H)-one
Smiles: CC1CN(C2CCCCC2)c2n(C1)c1c(O)nc(=O)n(c1n2)C

STL040840
Synonyms: 4-(4-chloro-3,5-dimethylphenoxy)-2-[4-(propan-2-yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(Oc2cc(C)c(c(c2)C)Cl)c2c(n1)cccc2)C

STL040841
Synonyms: 3-[5-(2,4-dichlorophenyl)furan-2-yl]-5-(naphthalen-1-yl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Clc1ccc(c(c1)Cl)c1ccc(o1)C1N(OC2C1C(=O)N(C2=O)c1cccc2c1cccc2)c1ccccc1

STL040843
Synonyms: (4Z)-6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-[(2-methoxyphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1ccccc1/N=c/1\nc(N)nc([nH]1)CSc1nnc(s1)N

STL040844
Synonyms: N-(3,5-dimethoxyphenyl)-2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1cc(OC)cc(c1)OC

STL040845
Synonyms: (5E)-1-phenyl-5-[(1-propyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1)S

STL040847
Synonyms: 2-{(E)-[2-({[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccccc2C(=O)O)nc2c(c1=O)cccc2

STL053586
Synonyms:
Smiles: O=S(=O)(c1cccc2c1nsn2)/N=c/1\[nH]c2ccccc2nc1NCCc1ccccc1

STL053691
Synonyms:
Smiles: Clc1cccc(c1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc2c1nsn2

STK832620
Synonyms: 2-{[3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(2-iodophenyl)acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1ccccc1I)c1cccs1

STK674168
Synonyms: (8S,8aR)-6-amino-8-[3-(methylsulfanyl)phenyl]-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: CCCN1CC=C2[C@H](C1)[C@@H](c1cccc(c1)SC)C(C(=C2C#N)N)(C#N)C#N

STK315434
Synonyms: 6-amino-1'-ethyl-2-propyl-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile
Smiles: CCCN1CC=C2C(C1)C1(CCN(CC1)CC)C(C(=C2C#N)N)(C#N)C#N

STL040848
Synonyms: 3-[(3-methoxybenzyl)sulfanyl]-4-methyl-5-phenyl-4H-1,2,4-triazole
Smiles: COc1cccc(c1)CSc1nnc(n1C)c1ccccc1

STL040849
Synonyms: (2Z)-2-[(3,5-dimethylphenyl)imino]-7-(4-methylphenyl)-2,6,7,8-tetrahydroquinazolin-5(1H)-one
Smiles: Cc1ccc(cc1)C1CC(=O)c2c(C1)[nH]/c(=N/c1cc(C)cc(c1)C)/nc2

STL040850
Synonyms: (4E)-5-(3,4-diethoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C

STL040851
Synonyms: 2'-(2-chlorophenyl)-7'-fluoro-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)C1N2c3ccc(cc3C=CC2C2(C1c1ccccc1Cl)C(=O)c1c(C2=O)cccc1)F

STL040852
Synonyms: (2E)-2-cyano-N-(2,4-dichlorophenyl)-2-[(5E)-5-(4-nitrobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2ccc(cc2)[N+](=O)[O-])/c(=O)n1c1ccccc1)/C(=O)Nc1ccc(cc1Cl)Cl

STL040853
Synonyms: 2-(4-chlorophenyl)-1-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium
Smiles: Clc1ccc(cc1)c1cn2c([n+]1c1ccccc1)CCCCC2

STL040854
Synonyms: (2Z)-2-[(2-fluorophenyl)imino]-5-nitro-N~6~-(tetrahydrofuran-2-ylmethyl)-1,2-dihydropyrimidine-4,6-diamine
Smiles: [O-][N+](=O)c1c(N)n/c(=N\c2ccccc2F)/[nH]c1NCC1CCCO1

STL040855
Synonyms: (5E)-1-(2-chlorophenyl)-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1Cl)S

STL040856
Synonyms: N'-{(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}-2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(s2)SCc2cccc3c2cccc3)ccc1OCc1ccccc1

STL040857
Synonyms: (2E)-N-{1-benzyl-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}-3-phenylprop-2-enamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NC(=O)/C=C/c2ccccc2)n(c2c1nc1ccccc1n2)Cc1ccccc1

STL040860
Synonyms: (5Z)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-[4-(2-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: Fc1ccc(cc1)c1ccc(o1)/C=C/1\SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-]

STL040861
Synonyms: (4E)-5-(3,4-dichlorophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)c1nc2c(s1)cc(cc2)C)/O

STL040862
Synonyms: 3'-(4-hydroxybenzyl)-5'-[3-(trifluoromethyl)phenyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Oc1ccc(cc1)CC1NC2(C3C1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C(=O)Nc1c2cccc1

STL040863
Synonyms: N-[(3Z)-1,6-dimethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)/N=c/1\[nH]n(c2c1cc1cc(C)ccc1n2)C

STL040864
Synonyms: 2-amino-1-{[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]amino}-N-(prop-2-en-1-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(c(c1)OCC)O

STL040865
Synonyms: 10-(3-bromophenyl)-9,11-dioxo-N-[3-(trifluoromethyl)phenyl]-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: Brc1cccc(c1)N1C(=O)C2C(C1=O)C1N(C2C(=O)Nc2cccc(c2)C(F)(F)F)C=Cc2c1cccc2