Chemical compounds for High-Throughput screening and
Building Blocks for Combinatorial chemistry

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STL011145
Synonyms: 9- fluoro- 6- [2- (piperidin- 1- yl)ethyl]- 6H- indolo[2,3- b]quinoxaline
Smiles: Fc1ccc2c(c1)c1nc3ccccc3nc1n2CCN1CCCCC1

STL011161
Synonyms: 4- ethyl- 3'- [4- (morpholin- 4- yl)phenyl]- 1'H- spiro[cyclohexane- 1,2'- quinazolin]- 4'(3'H)- one
Smiles: CCC1CCC2(CC1)Nc1ccccc1C(=O)N2c1ccc(cc1)N1CCOCC1

STL011167
Synonyms: 6- methyl- 2- [(naphthalen- 1- ylmethyl)sulfanyl]- 4- (trifluoromethyl)pyridine- 3- carbonitrile
Smiles: N#Cc1c(SCc2cccc3c2cccc3)nc(cc1C(F)(F)F)C

STL011171
Synonyms: 9- fluoro- 6- [2- (pyrrolidin- 1- yl)ethyl]- 6H- indolo[2,3- b]quinoxaline
Smiles: Fc1ccc2c(c1)c1nc3ccccc3nc1n2CCN1CCCC1

STL011175
Synonyms: N- [(2S)- 1- [(3- chloro- 4- fluorophenyl)amino]- 4- (methylsulfanyl)- 1- oxobutan- 2- yl]- 6,7- dimethoxy- 3,4- dihydroisoquinoline- 2(1H)- carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1ccc(c(c1)Cl)F)NC(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STL011189
Synonyms: 2- (ethylsulfanyl)- 6- methyl- 4- (trifluoromethyl)pyridine- 3- carbonitrile
Smiles: CCSc1nc(C)cc(c1C#N)C(F)(F)F

STL011213
Synonyms: 3'- (4- ethoxyphenyl)- 1'H- spiro[cyclohexane- 1,2'- quinazolin]- 4'(3'H)- one
Smiles: CCOc1ccc(cc1)N1C(=O)c2ccccc2NC21CCCCC2

STL011214
Synonyms: 5- methoxy- 2- [morpholin- 4- yl(phenyl)methyl]naphthalen- 1- ol
Smiles: COc1cccc2c1ccc(c2O)C(c1ccccc1)N1CCOCC1

STL011225
Synonyms: 3- (5,9- dimethyl- 7- oxo- 3- phenyl- 7H- furo[3,2- g]chromen- 6- yl)- N- (1H- tetrazol- 5- yl)propanamide
Smiles: O=C(Nc1nnn[nH]1)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccccc1

STL011236
Synonyms: 12- chloro- 3- (pyridin- 3- yl)- 3,4,7,8,9,10- hexahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: Clc1cc2c(c3c1OCN(C3)c1cccnc1)oc(=O)c1c2CCCC1

STL011243
Synonyms: 3- (2- ethoxyphenoxy)- 7- [2- oxo- 2- (piperidin- 1- yl)ethoxy]- 4H- chromen- 4- one
Smiles: CCOc1ccccc1Oc1coc2c(c1=O)ccc(c2)OCC(=O)N1CCCCC1

STL011245
Synonyms: N- [4- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2,5- oxadiazol- 3- yl]thiophene- 2- carboxamide
Smiles: O=C(c1cccs1)Nc1nonc1c1ccc2c(c1)CCCC2

STL011246
Synonyms: 1- ({[3- (4- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetyl)piperidine- 4- carboxamide
Smiles: COc1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)N1CCC(CC1)C(=O)N

STL011264
Synonyms: 7- cyclohexyl- 5,6- dimethyl- N- [2- (morpholin- 4- yl)ethyl]- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1c(C)n(c2c1c(NCCN1CCOCC1)ncn2)C1CCCCC1

STL011266
Synonyms: 1- (4- fluorobenzyl)- 2- [1- (thiophen- 2- ylsulfonyl)pyrrolidin- 2- yl]- 1H- benzimidazole
Smiles: Fc1ccc(cc1)Cn1c2ccccc2nc1C1CCCN1S(=O)(=O)c1cccs1

STL011292
Synonyms: N- (2- {[(4,6- dimethylpyrimidin- 2- yl)sulfanyl]methyl}- 1- ethyl- 1H- benzimidazol- 5- yl)propanamide
Smiles: CCC(=O)Nc1ccc2c(c1)nc(n2CC)CSc1nc(C)cc(n1)C

STL011295
Synonyms: N- {2- [4- (4- fluorophenyl)piperazin- 1- yl]- 2- oxoethyl}- 2- (4- oxo- 3,4- dihydrophthalazin- 1- yl)acetamide
Smiles: O=C(Cc1n[nH]c(=O)c2c1cccc2)NCC(=O)N1CCN(CC1)c1ccc(cc1)F

STL011302
Synonyms: 5- chloro- 2- (ethylsulfanyl)- N- (4- methylpyridin- 2- yl)pyrimidine- 4- carboxamide
Smiles: CCSc1ncc(c(n1)C(=O)Nc1nccc(c1)C)Cl

STL011312
Synonyms: 1- ({[3- (4- methoxyphenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetyl)piperidine- 4- carboxamide
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)N1CCC(CC1)C(=O)N

STL011324
Synonyms: ethyl3- ({N- [(4- oxo- 3,4- dihydrophthalazin- 1- yl)acetyl]glycyl}amino)benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)CNC(=O)Cc1n[nH]c(=O)c2c1cccc2

STL011328
Synonyms: 6- benzyl- 3- ({[1- (3,4- dichlorophenyl)- 1H- tetrazol- 5- yl]methyl}sulfanyl)- 1,2,4- triazin- 5- ol
Smiles: Oc1nc(SCc2nnnn2c2ccc(c(c2)Cl)Cl)nnc1Cc1ccccc1

STL011329
Synonyms: trans- N- [2- (3,4- dihydroisoquinolin- 2(1H)- yl)- 2- oxoethyl]- 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)NCC(=O)N1CCc2c(C1)cccc2

STL011344
Synonyms: N- [3- (1,3- benzoxazol- 2- yl)- 4- hydroxy- 5- methylphenyl]pentanamide
Smiles: CCCCC(=O)Nc1cc(C)c(c(c1)c1nc2c(o1)cccc2)O

STL011359
Synonyms: 1,7- dimethyl- 3- [(2E)- 3- phenylprop- 2- en- 1- yl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Cc1[nH]c2n(c1)c1c(n2)n(C)c(=O)n(c1=O)C/C=C/c1ccccc1

STL011371
Synonyms: 1- [3- (1H- indol- 3- yl)propanoyl]- N- (pyridin- 2- ylmethyl)piperidine- 3- carboxamide
Smiles: O=C(N1CCCC(C1)C(=O)NCc1ccccn1)CCc1c[nH]c2c1cccc2

STL011372
Synonyms: 2- chloro- N- [1- (furan- 2- ylmethyl)- 5- oxo- 2- phenyl- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]benzamide
Smiles: Clc1ccccc1C(=O)NC1(N=C(N(C1=O)Cc1ccco1)c1ccccc1)C(F)(F)F

STL011378
Synonyms: trans- N- {(2S)- 1- [(furan- 2- ylmethyl)amino]- 1- oxopropan- 2- yl}- 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)N[C@H](C(=O)NCc1ccco1)C

STL011400
Synonyms: N- butyl- N- methyl- 2- [(2- methyl- 4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: CCCCN(C(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C)C

STL011433
Synonyms: N- (2- fluorophenyl)- 2- (4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: Fc1ccccc1NC(=O)C(n1cnc2c(c1=O)cccc2)C

STL011435
Synonyms: 3- {[3- cyano- 4- (trifluoromethyl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (1,3- thiazol- 2- yl)propanamide
Smiles: N#Cc1c(SCCC(=O)Nc2nccs2)nc2c(c1C(F)(F)F)CCCC2

STL011436
Synonyms: 6- phenyl- 2- (prop- 2- en- 1- ylsulfanyl)- 4- (trifluoromethyl)pyridine- 3- carbonitrile
Smiles: C=CCSc1nc(cc(c1C#N)C(F)(F)F)c1ccccc1

STL011444
Synonyms: 3- [4- (dimethylamino)benzyl]- 2- methyl- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: OC1C(Cc2ccc(cc2)N(C)C)N(C)S(=O)(=O)c2c1cccc2

STL011448
Synonyms: N- (4- fluorobenzyl)- 2- [(5- hydroxy- 4- oxo- 2- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(NCc1ccc(cc1)F)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1

STL011453
Synonyms: ethyl{4- (4- methylphenyl)- 2- [(2- methylpropanoyl)amino]- 1,3- thiazol- 5- yl}carbamate
Smiles: CCOC(=O)Nc1sc(nc1c1ccc(cc1)C)NC(=O)C(C)C

STL011461
Synonyms: 4- oxo- N- [4- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2,5- oxadiazol- 3- yl]- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)Nc1nonc1c1ccc2c(c1)CCCC2

STL011470
Synonyms: 3,3,6,7- tetramethyl- N- (1- phenylethyl)- 3,4- dihydroisoquinolin- 1- amine
Smiles: CC(c1ccccc1)NC1=NC(C)(C)Cc2c1cc(C)c(c2)C

STL011481
Synonyms: 2- methyl- 7- [2- (4- methylpiperazin- 1- yl)- 2- oxoethoxy]- 3- phenyl- 4H- chromen- 4- one
Smiles: CN1CCN(CC1)C(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STL011485
Synonyms: [8- (4- methoxyphenyl)- 1- methyl- 2,4- dioxo- 7- phenyl- 1,2,4,8- tetrahydro- 3H- imidazo[2,1- f]purin- 3- yl]aceticacid
Smiles: COc1ccc(cc1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)O)c1ccccc1

STL011490
Synonyms: trans- N- {(2R)- 1- [(3- fluorophenyl)amino]- 1- oxopropan- 2- yl}- 4- ({[(4- methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: O=C([C@H](NC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)C)C)Nc1cccc(c1)F

STL011493
Synonyms: 2- [(4- ethyl- 7- methyl- 2- oxo- 2H- chromen- 5- yl)oxy]- N- [2- (morpholin- 4- yl)ethyl]propanamide
Smiles: CCc1cc(=O)oc2c1c(cc(c2)C)OC(C(=O)NCCN1CCOCC1)C

STL011498
Synonyms: N- (3- methoxyphenyl)- 2- (2- methyl- 5- oxo- 5,6- dihydro- 4H- imidazo[1,2- b][1,2,4]triazol- 6- yl)acetamide
Smiles: COc1cccc(c1)NC(=O)CC1C(=O)Nc2n1nc(n2)C

STL011499
Synonyms: 2- [2- (benzylsulfanyl)- 5- oxo- 5,6- dihydro- 4H- imidazo[1,2- b][1,2,4]triazol- 6- yl]- N- phenylacetamide
Smiles: O=C(CC1C(=O)Nc2n1nc(n2)SCc1ccccc1)Nc1ccccc1

STL036695
Synonyms: (2Z,4E)- 5- (4- chlorophenyl)- 3- methylpenta- 2,4- dienoate
Smiles: C/C(=C/C(=O)[O-])/C=C/c1ccc(cc1)Cl

STL036697
Synonyms: N,N- dimethyl- N- (prop- 2- yn- 1- yl)dodecan- 1- aminium
Smiles: CCCCCCCCCCCC[N+](CC#C)(C)C

STL036698
Synonyms: N- benzyl- N,9- bis(3- bromobenzyl)- 9H- purin- 6- amine
Smiles: Brc1cccc(c1)CN(c1ncnc2c1ncn2Cc1cccc(c1)Br)Cc1ccccc1

STL036700
Synonyms: N,N,N- trimethyl- 4- [(tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)oxy]butan- 1- aminium
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)OCCCC[N+](C)(C)C

STL036701
Synonyms: 3- chloro- 1- (cyclohexylamino)- 7- ethyl- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: CCN1CCc2c(C1)c(NC1CCCCC1)nc(c2C#N)Cl

STL036705
Synonyms: 2- (8- bromo- 3- methyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)propanoate
Smiles: [O-]C(=O)C(n1c(Br)nc2c1c(=O)[nH]c(=O)n2C)C

STL036709
Synonyms: 1- methyl- 4- [(E)- 2- (1- methyl- 1H- indol- 3- yl)ethenyl]pyridinium
Smiles: C[n+]1ccc(cc1)/C=C/c1cn(c2c1cccc2)C

STL036713
Synonyms: 6- chloro- 2- methyl- 4- phenylquinoline- 3- carboxylate
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(n2)C)C(=O)[O-]

STL036722
Synonyms: 1- (5- bromo- 2- methoxybenzyl)- 1- methylpiperidinium
Smiles: COc1ccc(cc1C[N+]1(C)CCCCC1)Br

STL036723
Synonyms: N- (but- 2- yn- 1- yl)- N,N- dimethyloctan- 1- aminium
Smiles: CCCCCCCC[N+](CC#CC)(C)C

STL036725
Synonyms: 3- (3,4- dimethylphenyl)- 3- hydroxy- 1- methyl- 2- methylidene- 1- azoniabicyclo[2.2.2]octane
Smiles: Cc1ccc(cc1C)C1(O)C2CC[N+](C1=C)(CC2)C

STL036727
Synonyms: N,N,N- trimethyl(2- oxocyclohexyl)methanaminium
Smiles: O=C1CCCCC1C[N+](C)(C)C

STL036731
Synonyms: methyl4- {[2- (pyridin- 4- yl)quinazolin- 4- yl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccncc1

STL036733
Synonyms: 3- (3- methylphenyl)- 1,3- diazaspiro[4.5]decane- 2,4- dione
Smiles: Cc1cccc(c1)N1C(=O)NC2(C1=O)CCCCC2

STL036735
Synonyms: N- (3- chlorophenyl)- 3- [4- (3- chlorophenyl)piperazin- 1- yl]propanamide
Smiles: O=C(Nc1cccc(c1)Cl)CCN1CCN(CC1)c1cccc(c1)Cl

STL036736
Synonyms: hydroxy[3- (hydroxyamino)- 3- methylbutan- 2- yl]ammonium
Smiles: O[NH2+]C(C(NO)(C)C)C

STL036739
Synonyms: 3- [(2- hydroxyethyl)amino]- 5- methylphenazin- 5- ium
Smiles: OCCNc1ccc2c(c1)[n+](C)c1c(n2)cccc1

STL036740
Synonyms: 1,3- dimethyl- 2,6- dioxo- 5- (3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 1,2,3,6- tetrahydropyrimidin- 4- olate
Smiles: O=C1OC(c2c1cccc2)c1c([O-])n(C)c(=O)n(c1=O)C

STL036741
Synonyms: 2- (ethylsulfanyl)- 6- oxo- 3- phenyl- 3,6- dihydropyrimidin- 4- olate
Smiles: CCSc1nc(=O)cc(n1c1ccccc1)[O-]

STL036744
Synonyms: 4- [(5- ethyl- 2- hydroxy- 4,6- dioxo- 5- phenyl- 5,6- dihydropyrimidin- 1(4H)- yl)methyl]morpholin- 4- ium
Smiles: CCC1(c2ccccc2)C(=O)N=C(N(C1=O)C[NH+]1CCOCC1)O

STL036745
Synonyms: 5- (4- hydroxyphthalazin- 1- yl)- 2- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1S(=O)(=O)N)c1nnc(c2c1cccc2)O

STL036753
Synonyms: (5Z)- 3- (3- chlorophenyl)- 6- hydroxy- 5- [(5- methylfuran- 2- yl)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: Clc1cccc(c1)N1C(=O)N=C(/C(=C/c2ccc(o2)C)/C1=O)O

STL036758
Synonyms: 7- butyl- 8- [(furan- 2- ylmethyl)amino]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCn1c(NCc2ccco2)nc2c1c(O)nc(=O)n2C

STL036762
Synonyms: 4- (3- bromophenyl)- 1- chloro- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinolinium- 6- carboxylate
Smiles: Brc1cccc(c1)C1[NH2+]c2c(C3C1CC(C3Cl)Sc1ccccc1[N+](=O)[O-])cccc2C(=O)[O-]

STL036776
Synonyms: methyl6,7- dichloro- 3- oxo- 3,4- dihydroquinoxaline- 2- carboxylate1,4- dioxide
Smiles: COC(=O)C1=[N+]([O-])c2c([N+](C1=O)[O-])cc(c(c2)Cl)Cl

STL036778
Synonyms: (1E)- 2- ethyl- 1- [(4- fluorophenyl)imino]- 3- methyl- 1,5- dihydropyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(/c/1=N/c1ccc(cc1)F)c1ccccc1[nH]2

STL036781
Synonyms: 2- [(E)- (2- {[4- (4- methylbenzyl)piperazin- 1- ium- 1- yl]acetyl}hydrazinylidene)methyl]- 6- (prop- 2- en- 1- yl)phenolate
Smiles: C=CCc1cccc(c1[O-])/C=N/NC(=O)C[NH+]1CCN(CC1)Cc1ccc(cc1)C

STL036791
Synonyms: (2E)- 2- {[(2,4- dichlorophenyl)carbonyl]amino}- 3- [4- (dimethylammonio)phenyl]prop- 2- enoate
Smiles: Clc1ccc(c(c1)Cl)C(=O)N/C(=C/c1ccc(cc1)[NH+](C)C)/C(=O)[O-]

STL036803
Synonyms: 8- {[2- (diethylamino)ethyl]amino}- 6- hydroxy- 3- methyl- 7- propyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCn1c(NCCN(CC)CC)nc2c1c(O)nc(=O)n2C

STL036806
Synonyms: 1- [N'- (4- chloro- 2,5- dimethoxyphenyl)- N- (4,6- dimethylpyrimidin- 2- yl)carbamimidoyl]- 3- ethylurea
Smiles: CCNC(=O)N/C(=N\c1cc(OC)c(cc1OC)Cl)/Nc1nc(C)cc(n1)C

STL036817
Synonyms: (5Z)- 1- (4- chlorophenyl)- 2- hydroxy- 5- (1H- indol- 3- ylmethylidene)pyrimidine- 4,6(1H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C/c2c[nH]c3c2cccc3)/C1=O)O

STL036818
Synonyms: 2- (4- {[(1Z)- 4- methylphthalazin- 1(2H)- ylidene]amino}phenyl)acetamide
Smiles: NC(=O)Cc1ccc(cc1)/N=c/1\[nH]nc(c2c1cccc2)C

STL036823
Synonyms: 1- ethyl- 2- hydroxy- 4- oxo- N'- [(E)- pyridin- 4- ylmethylidene]- 1,4- dihydroquinoline- 3- carbohydrazide
Smiles: CCn1c(O)c(C(=O)N/N=C/c2ccncc2)c(=O)c2c1cccc2

STL036833
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 6- hydroxy- 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(Cn1c(NCCN(C)C)nc2c1c(O)nc(=O)n2C)COc1ccccc1C

STL036842
Synonyms: dimethyl5- [({(2E)- 4- hydroxy- 2- [(4- methoxyphenyl)imino]- 5,6- dihydro- 2H- 1,3- thiazin- 6- yl}carbonyl)amino]benzene- 1,3- dicarboxylate
Smiles: COc1ccc(cc1)/N=C/1\N=C(O)CC(S1)C(=O)Nc1cc(cc(c1)C(=O)OC)C(=O)OC

STL036849
Synonyms: butyl4- {[(2,4- dihydroxy- 5,6,7,8- tetrahydroquinolin- 3- yl)carbonyl]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)c1c(O)nc2c(c1O)CCCC2

STL036859
Synonyms: N- [(2Z)- 4,6- dimethylpyrimidin- 2(1H)- ylidene]- 3a,4,5,6,7,7a- hexahydro- 1H- benzimidazol- 2- amine
Smiles: Cc1cc(C)[nH]/c(=N/C2=NC3C(N2)CCCC3)/n1

STL036863
Synonyms: 7- hydroxy- N- [(2E)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 5- oxo- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: Cc1n[nH]/c(=N\C(=O)c2c(O)c3cccc4c3n(c2=O)CCC4)/s1

STL036867
Synonyms: 3- (4- hydroxy- 6- methyl- 2- sulfanylpyrimidin- 5- yl)propanoicacid
Smiles: OC(=O)CCc1c(C)nc(nc1O)S

STL036873
Synonyms: 2,4- dichloro- 6- {[(1- propyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: CCCn1c(NCc2cc(Cl)cc(c2[O-])Cl)[nH+]c2c1cccc2

STL036886
Synonyms: methyl(2Z)- [(2Z)- 4- hydroxy- 2- {[(4- methoxyphenyl)carbonyl]imino}- 1,3- thiazol- 5(2H)- ylidene]ethanoate
Smiles: COC(=O)/C=C/1\S/C(=N\C(=O)c2ccc(cc2)OC)/N=C1O

STL036891
Synonyms: 4- [1- hydroxy- 3,3- dimethyl- 10- (phenylcarbonyl)- 3,4,10,11- tetrahydro- 2H- dibenzo[b,e][1,4]diazepin- 11- yl]benzonitrile
Smiles: N#Cc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1ccccc1)cccc2)(C)C

STL036894
Synonyms: (E)- [1- (furan- 2- ylmethyl)- 4,5- dioxo- 2- (pyridinium- 3- yl)pyrrolidin- 3- ylidene](phenyl)methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccccc2)/[O-])/C(N1Cc1ccco1)c1ccc[nH+]c1

STL036896
Synonyms: (E)- [4,5- dioxo- 2- (4- propoxyphenyl)- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](4- methylphenyl)methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL036904
Synonyms: N- [2- {(2E)- 2- [(1,3- dimethyl- 1H- pyrazol- 4- yl)methylidene]hydrazinyl}- 2- oxo- 1- (4- oxo- 3,4- dihydrophthalazin- 1- yl)ethyl]benzamide
Smiles: O=C(C(c1n[nH]c(=O)c2c1cccc2)NC(=O)c1ccccc1)N/N=C/c1cn(nc1C)C

STL036907
Synonyms: (E)- {2- (2- fluorophenyl)- 1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}(3- methoxyphenyl)methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)CCCn1cc[nH+]c1)/[O-]

STL036913
Synonyms: (5E)- 1- (2- methylphenyl)- 5- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NCCCN1CCOCC1)c1ccccc1C

STL036914
Synonyms: 2- (3- methylbutyl)- 1,2,4- triazaspiro[4.5]dec- 3- ene- 3- thiol
Smiles: CC(CCN1NC2(N=C1S)CCCCC2)C

STL036924
Synonyms: 2- methoxy- 4- (7- methyl- 4- oxo- 1,2,3,4,5,6,7,8- octahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 7- ium- 2- yl)phenolate
Smiles: COc1cc(ccc1[O-])C1NC(=O)c2c(N1)sc1c2CC[NH+](C1)C

STL036932
Synonyms: 7- (2,4- dichlorophenyl)- 5- phenyl- 3,7- dihydrotetrazolo[1,5- a]pyrimidine
Smiles: Clc1ccc(c(c1)Cl)C1C=C(N=c2n1nn[nH]2)c1ccccc1

STL036937
Synonyms: 3- {[(2E)- 6- methyl- 4- phenylquinazolin- 2(3H)- ylidene]amino}benzoicacid
Smiles: Cc1ccc2c(c1)c([nH]/c(=N\c1cccc(c1)C(=O)O)/n2)c1ccccc1

STL036944
Synonyms: N- (1- hydroxy- 2- methylpropan- 2- yl)- 5- (4- hydroxyphthalazin- 1- yl)- 2- methylbenzenesulfonamide
Smiles: OCC(NS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)O)(C)C

STL036949
Synonyms: (E)- [4,5- dioxo- 2- (4- propoxyphenyl)- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](4- fluorophenyl)methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL036960
Synonyms: 6- (ethylsulfonyl)- 3- [(Z)- 2- hydroxy- 2- phenylethenyl]- 2H- 1,4- benzoxazin- 2- one
Smiles: CCS(=O)(=O)c1ccc2c(c1)nc(c(=O)o2)/C=C(/c1ccccc1)\O

STL036965
Synonyms: ethyl2- cyano- 3- (5- methyl- 3- oxo- 2,3- dihydro- 1H- pyrazol- 4- yl)- 3- (pyridin- 3- yl)propanoate
Smiles: CCOC(=O)C(C(c1c(C)[nH][nH]c1=O)c1cccnc1)C#N

STL036991
Synonyms: N- [2- (2- {(Z)- [4- hydroxy- 1- (3- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 1H- indol- 3- yl)ethyl]propanamide
Smiles: CCC(=O)NCCc1c(/C=C\2/C(=NC(=O)N(C2=O)c2cccc(c2)C)O)[nH]c2c1cccc2

STL037011
Synonyms: 4- {(3E)- 2- (4- chlorophenyl)- 3- [hydroxy(phenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}benzenesulfonamide
Smiles: Clc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(cc1)S(=O)(=O)N

STL037017
Synonyms: (E)- (2- methylimidazo[1,2- a]pyridin- 3- yl){1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxo- 2- phenylpyrrolidin- 3- ylidene}methanolate
Smiles: O=C1C(=O)/C(=C(\c2c(C)nc3n2cccc3)/[O-])/C(N1CCC[NH+]1CCOCC1)c1ccccc1

STL037022
Synonyms: ethyl4- {[(4E)- 1- methyl- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)/N=c\1/nc[nH]c2c1cnn2C

STL037024
Synonyms: (5Z)- 1- methyl- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN1C(=NC(=O)/C(=C/c2cccn2C)/C1=O)S

STL037044
Synonyms: 5- amino- 1- (4- hydroxy- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)- 1H- pyrazole- 4- carbonitrile
Smiles: N#Cc1cnn(c1N)c1nc(O)c2c(n1)sc1c2CC(OC1)(C)C

STL037046
Synonyms: 1- benzyl- 2- hydroxy- N- (3- methylpyridin- 2- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: Cc1cccnc1NC(=O)c1c(=O)c2ccccc2n(c1O)Cc1ccccc1

STL037079
Synonyms: 3- {(3E)- 3- [hydroxy(4- methylphenyl)methylidene]- 4,5- dioxo- 2- phenylpyrrolidin- 1- yl}benzoicacid
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1cccc(c1)C(=O)O)/O

STL037094
Synonyms: (E)- [2- (4- hydroxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene][4- (propan- 2- yloxy)phenyl]methanolate
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)Cc1ccc[nH+]c1)/[O-])C

STL037095
Synonyms: 5- bromo- 2- hydroxy- 1- [(4- propoxyphenyl)sulfonyl]pyrimidin- 4(1H)- one
Smiles: CCCOc1ccc(cc1)S(=O)(=O)n1cc(Br)c(=O)nc1O

STL037096
Synonyms: 1- [(2E)- 5- benzyl- 4- hydroxy- 6- methylpyrimidin- 2(1H)- ylidene]- 3- (3- chloro- 2- methylphenyl)guanidine
Smiles: N=C(Nc1cccc(c1C)Cl)/N=c\1/nc(O)c(c([nH]1)C)Cc1ccccc1

STL037097
Synonyms: N- [2- (2- {(Z)- [4,6- dioxo- 1- (prop- 2- en- 1- yl)- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 1H- indol- 3- yl)ethyl]propanamide
Smiles: C=CCN1C(=NC(=O)/C(=C/c2[nH]c3c(c2CCNC(=O)CC)cccc3)/C1=O)S

STL037103
Synonyms: 5',6',7',8'- tetrahydro- 3'H- spiro[cyclohexane- 1,9'- [1,2,4]triazolo[5,1- b]quinazolin]- 2'- amine
Smiles: Nc1[nH]c2=NC3=C(C4(n2n1)CCCCC4)CCCC3

STL037105
Synonyms: 2- [(1H- 3,1- benzimidazol- 3- ium- 2- ylamino)methyl]- 4- bromophenolate
Smiles: Brc1ccc(c(c1)CNc1[nH]c2c([nH+]1)cccc2)[O-]

STL037123
Synonyms: 1- (prop- 1- en- 2- yl)- 1H- benzimidazol- 2- ol
Smiles: CC(=C)n1c(O)nc2c1cccc2

STL037135
Synonyms: 7- (2,4- dichlorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Clc1ccc(c(c1)Cl)C1C=C(N=c2n1nc[nH]2)c1ccccc1

STL037151
Synonyms: 2- amino- 5- hydroxy- 7- methyl- 4- (2,4,5- trimethoxyphenyl)- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc(OC)c(cc1OC)OC)c(O)nc(c2)C

STL037164
Synonyms: N- cyclohexyl- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 2- carboxamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1ccccn1)C1CCCCC1

STL037169
Synonyms: N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (3- methylphenyl)pyridine- 3- carboxamide
Smiles: Cc1cccc(c1)N(C(=O)c1cccnc1)Cc1cc2cc(C)ccc2[nH]c1=O

STL037174
Synonyms: (E)- 1- benzofuran- 2- yl{1- [2- (diethylammonio)ethyl]- 2- (4- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: CC[NH+](CCN1C(c2ccc(cc2)F)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)CC

STL037183
Synonyms: (4E)- 5- (4- bromophenyl)- 4- [hydroxy(4- methoxyphenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C\1/C(NC(=O)C1=O)c1ccc(cc1)Br)/O

STL037189
Synonyms: 6- chloro- 10- (2,4- dimethylphenyl)- 4- hydroxypyrimido[4,5- b]quinolin- 2(10H)- one
Smiles: Cc1ccc(c(c1)C)n1c2cccc(c2cc2c1nc(=O)nc2O)Cl

STL037202
Synonyms: 3- [(5- ethyl- 4- hydroxy- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]- 1- phenylpyrrolidine- 2,5- dione
Smiles: CCc1c(O)nc([nH]c1=O)SC1CC(=O)N(C1=O)c1ccccc1

STL037203
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- oxo- N- (propan- 2- yl)- 1,2- dihydroquinoline- 4- carboxamide
Smiles: O=c1[nH]c2ccccc2c(c1)C(=O)N(c1c(=O)n(n(c1C)C)c1ccccc1)C(C)C

STL037204
Synonyms: 3- hydroxy- 4- [(E)- {2- [(1- methyl- 1H- indolium- 3- yl)carbonyl]hydrazinylidene}methyl]phenolate
Smiles: [O-]c1ccc(c(c1)O)/C=N/NC(=O)C1=C[NH+](c2c1cccc2)C

STL037209
Synonyms: (5Z)- 1- acetyl- 5- [(2- hydroxy- 8- methylquinolin- 3- yl)methylidene]- 2- sulfanyl- 1,5- dihydro- 4H- imidazol- 4- one
Smiles: CC(=O)N1C(=NC(=O)/C/1=C/c1cc2cccc(c2nc1O)C)S

STL037212
Synonyms: 6- ethyl- 3- (1- methyl- 1H- benzimidazol- 2- yl)- 8- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 4- oxo- 2- (propan- 2- yl)- 4H- chromen- 7- olate
Smiles: CCc1cc2c(c(c1[O-])C[NH+]1CCN(CC1)C)oc(c(c2=O)c1nc2c(n1C)cccc2)C(C)C

STL037213
Synonyms: (3Z)- 3- [(2E)- (2- oxo- 2,3- dihydropyrimidin- 4(1H)- ylidene)hydrazinylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Nc2c(/C/1=N/N=c/1\cc[nH]c(=O)[nH]1)cccc2

STL037219
Synonyms: 3- {[(1E)- 4- [4- methyl- 3- (morpholin- 4- ylsulfonyl)phenyl]phthalazin- 1(2H)- ylidene]amino}phenol
Smiles: Oc1cccc(c1)/N=c\1/[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCOCC1)C

STL037224
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 1- (2- hydroxyethyl)- 5- (4- hydroxy- 3- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccc(c(c1)OC)O

STL037228
Synonyms: 2- [(Z)- 2- (1H- 3,1- benzimidazol- 3- ium- 2- yl)- 1- hydroxyethenyl]- 4- chloro- 5- hydroxyphenolate
Smiles: [O-]c1cc(O)c(cc1/C(=C/c1[nH]c2c([nH+]1)cccc2)/O)Cl

STL037251
Synonyms: 2- [6- hydroxy- 3- methyl- 8- (4- methylpiperazin- 1- yl)- 2- oxo- 2,3- dihydro- 7H- purin- 7- yl]acetamide
Smiles: CN1CCN(CC1)c1nc2c(n1CC(=O)N)c(O)nc(=O)n2C

STL037260
Synonyms: 2,4- dihydroxy- N- (3- methylphenyl)- 5,6,7,8- tetrahydroquinoline- 3- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1c(O)nc2c(c1O)CCCC2

STL037261
Synonyms: 2- (1,3- benzoxazol- 2- ylamino)- 5,6- dimethylpyrimidin- 4(3H)- one
Smiles: Cc1nc(Nc2nc3c(o2)cccc3)[nH]c(=O)c1C

STL037269
Synonyms: 3- [(Z)- 2- (4- bromophenyl)- 2- hydroxyethenyl]- 2H- 1,4- benzoxazin- 2- one
Smiles: Brc1ccc(cc1)/C(=C/c1nc2ccccc2oc1=O)/O

STL037270
Synonyms: 5- [(1E)- 1- (2- methyl- 2- phenylhydrazinylidene)ethyl]pyrimidine- 2,4,6- triol
Smiles: Oc1nc(O)c(c(n1)O)/C(=N/N(c1ccccc1)C)/C

STL037274
Synonyms: (5E)- 1- (butan- 2- yl)- 5- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCC(N1C(=NC(=O)/C(=C\NCCCN2CCOCC2)/C1=O)S)C

STL037291
Synonyms: (5Z)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 3- (furan- 2- ylmethyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CN(CCCN/C=C\1/C(=NC(=O)N(C1=O)Cc1ccco1)O)C

STL037295
Synonyms: (E)- [1- (1,3- benzothiazol- 3- ium- 2- yl)- 2- (4- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene](4- methylphenyl)methanolate
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1c1sc2c([nH+]1)cccc2

STL037304
Synonyms: 8- (cyclohexylamino)- 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCc1ccc(cc1)OCC(Cn1c(NC2CCCCC2)nc2c1c(O)nc(=O)n2C)O

STL037305
Synonyms: methyl(2E)- 2- {(2E)- [4- (dimethylamino)benzylidene]hydrazinylidene}- 4- hydroxy- 2H- 1,3- thiazine- 6- carboxylate
Smiles: COC(=O)c1cc(O)n/c(=N\N=C\c2ccc(cc2)N(C)C)/s1

STL037313
Synonyms: 7,7,8a- trimethyl- 2,3,8,8a- tetrahydro- 7H- [1,3]oxazolo[3,2- c]pyrimidine- 5- thiol
Smiles: SC1=NC(C)(C)CC2(N1CCO2)C

STL037340
Synonyms: 1- (4- chlorophenyl)- 3- [(2Z)- 5- [(4- methoxyphenoxy)methyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: COc1ccc(cc1)OCc1n[nH]/c(=N/C(=O)Nc2ccc(cc2)Cl)/s1

STL037346
Synonyms: 2- methoxy- 4- [5- oxo- 1- phenyl- 4- (phenylammonio)- 2,5- dihydro- 1H- pyrrol- 2- yl]phenolate
Smiles: COc1cc(ccc1[O-])C1C=C(C(=O)N1c1ccccc1)[NH2+]c1ccccc1

STL037349
Synonyms: N- {(E)- [1- (4- fluorophenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}methionine
Smiles: CSCCC(C(=O)O)N/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)F)O

STL037354
Synonyms: (5E)- 1- cyclohexyl- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN(CCCN/C=C/1\C(=O)N=C(N(C1=O)C1CCCCC1)S)C

STL037368
Synonyms: (6Z)- 6- {(2E)- [(2E)- 3- (2- methoxyphenyl)prop- 2- en- 1- ylidene]hydrazinylidene}- 5,6- dihydro[1,2,4]triazolo[3,4- a]phthalazine
Smiles: COc1ccccc1/C=C/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2

STL037369
Synonyms: 4- [(E)- {2- [(1H- 3,1- benzimidazol- 3- ium- 2- ylsulfanyl)acetyl]hydrazinylidene}methyl]- 2- methoxyphenolate
Smiles: COc1cc(/C=N/NC(=O)CSc2[nH]c3c([nH+]2)cccc3)ccc1[O-]

STL037383
Synonyms: {(3Z)- 3- [(2E)- 2- [(2,3- dimethylphenyl)imino]- 4- hydroxy- 1,3- thiazol- 5(2H)- ylidene]- 2- oxo- 2,3- dihydro- 1H- indol- 1- yl}aceticacid
Smiles: OC(=O)CN1c2ccccc2/C(=C\2/S/C(=N/c3cccc(c3C)C)/N=C2O)/C1=O

STL037389
Synonyms: (E)- (4- fluorophenyl)[2- (4- nitrophenyl)- 4,5- dioxo- 1- (pyrimidin- 1- ium- 2- yl)pyrrolidin- 3- ylidene]methanolate
Smiles: Fc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1nccc[nH+]1)/[O-]

STL037392
Synonyms: 6,6- dimethyl- 9- (naphthalen- 1- yl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2cccc4c2cccc4)ncn3)CC(C1)(C)C

STL037394
Synonyms: (5E)- 3- (3- chlorophenyl)- 6- hydroxy- 5- ({[2- (morpholin- 4- yl)ethyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: Clc1cccc(c1)N1C(=O)N=C(/C(=C\NCCN2CCOCC2)/C1=O)O

STL037395
Synonyms: 2- bromo- 6- methoxy- 4- [(E)- (2- {[(1- methyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: COc1cc(/C=N/NC(=O)CSc2[nH+]c3c(n2C)cccc3)cc(c1[O-])Br

STL037407
Synonyms: 2- hydroxy- 3- {[(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]amino}- 7- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)[nH]c1c2nc(n(c1=O)/N=C/c1cccc(c1O)OC)O

STL037444
Synonyms: (E)- [4,5- dioxo- 2- (3- propoxyphenyl)- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](thiophen- 2- yl)methanolate
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL037451
Synonyms: N- tert- butyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 4- carboxamide
Smiles: O=C(N(C(C)(C)C)Cc1cc2ccccc2[nH]c1=O)c1ccncc1

STL037462
Synonyms: N- tert- butyl- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 3- carboxamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(C)(C)C)C(=O)c1cccnc1

STL037463
Synonyms: methyl4- {[(7E)- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(4H)- ylidene]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)/N=c/1\cc(C)[nH]c2n1ncn2

STL037474
Synonyms: N- cyclohexyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]acetamide
Smiles: CC(=O)N(C1CCCCC1)Cc1cc2ccccc2[nH]c1=O

STL037481
Synonyms: methyl6- [(2- amino- 2- oxoethyl)sulfanyl]- 5- cyano- 2- hydroxy- 4- (4- methylphenyl)- 3,4- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=NC(=C(C1c1ccc(cc1)C)C#N)SCC(=O)N)O

STL037486
Synonyms: (5E)- 5- [(5- nitrofuran- 2- yl)methylidene]- 1- phenyl- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccc(o1)[N+](=O)[O-])c1ccccc1

STL037488
Synonyms: N- (7- oxo- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)propanamide
Smiles: CCC(=O)Nc1nn2c([nH]1)nc(cc2=O)c1ccccc1

STL037496
Synonyms: 7- amino- 4,8- dimethylquinolin- 2- ol
Smiles: Oc1cc(C)c2c(n1)c(C)c(cc2)N

STL037497
Synonyms: 1,5- bis[4- (trifluoromethyl)phenyl]- 1H,5H- [1,2,4]triazolo[1,2- a][1,2,4]triazole- 3,7- dithiol
Smiles: FC(c1ccc(cc1)C1N=C(N2N1C(=NC2c1ccc(cc1)C(F)(F)F)S)S)(F)F

STL037508
Synonyms: 7- (4- chlorophenyl)- 5- (3,4- dimethoxyphenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: COc1cc(ccc1OC)C1=CC(c2ccc(cc2)Cl)n2c(=N1)[nH]cn2

STL037510
Synonyms: N- tert- butyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]butanamide
Smiles: CCCC(=O)N(C(C)(C)C)Cc1cc2ccc(cc2[nH]c1=O)C

STL037517
Synonyms: 7- (2- chlorophenyl)- 5- (4- methoxyphenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: COc1ccc(cc1)C1=CC(c2ccccc2Cl)n2c(=N1)[nH]cn2

STL037529
Synonyms: 4- (4- fluorophenyl)- 7- hydroxy- 1- (pentan- 3- yl)- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: CCC(n1[nH]c(=O)c2c1N=C(O)CSC2c1ccc(cc1)F)CC

STL037531
Synonyms: (6Z)- 6- [(2E)- (4- propoxybenzylidene)hydrazinylidene]- 5,6- dihydro[1,2,4]triazolo[3,4- a]phthalazine
Smiles: CCCOc1ccc(cc1)/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2

STL037551
Synonyms: 1- (4- ethoxyphenyl)- 3- [(2Z)- 6- methyl- 4- (trifluoromethyl)pyrimidin- 2(1H)- ylidene]guanidine
Smiles: CCOc1ccc(cc1)NC(=N)/N=c/1\nc(cc([nH]1)C)C(F)(F)F

STL037555
Synonyms: N- (4- ethoxyphenyl)- 3- methoxy- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: CCOc1ccc(cc1)N(C(=O)c1cccc(c1)OC)Cc1cc2cc(C)ccc2[nH]c1=O

STL037559
Synonyms: 4- [(5- bromo- 2- hydroxybenzyl)amino]- N- [(2E)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]benzenesulfonamide
Smiles: CCc1n[nH]/c(=N\S(=O)(=O)c2ccc(cc2)NCc2cc(Br)ccc2O)/s1

STL037562
Synonyms: 2- methyl- 3- propylpyrimido[1,2- a]benzimidazol- 4(10H)- one
Smiles: CCCc1c(C)nc2n(c1=O)c1ccccc1[nH]2

STL037567
Synonyms: (E)- [2- (2- methoxyphenyl)- 4,5- dioxo- 1- (pyridinium- 2- yl)pyrrolidin- 3- ylidene](thiophen- 2- yl)methanolate
Smiles: COc1ccccc1C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1c1cccc[nH+]1

STL037570
Synonyms: 5- {[(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}- 4H- pyrazol- 3- ol
Smiles: Cc1nnc(s1)SCC1=NN=C(C1)O

STL037581
Synonyms: (E)- (4- methoxyphenyl)[2- (naphthalen- 1- yl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc2c1cccc2)Cc1ccc[nH+]c1)/[O-]

STL037589
Synonyms: 4- methoxy- N'- [(1E)- 1- (2,4,6- trihydroxypyrimidin- 5- yl)ethylidene]benzohydrazide
Smiles: COc1ccc(cc1)C(=O)N/N=C(/c1c(O)nc(nc1O)O)\C

STL037593
Synonyms: 2- {4- [1- (4- ethoxyphenyl)- 2,5- dioxopyrrolidin- 3- yl]piperazin- 4- ium- 1- yl}phenolate
Smiles: CCOc1ccc(cc1)N1C(=O)CC(C1=O)[NH+]1CCN(CC1)c1ccccc1[O-]

STL037613
Synonyms: 2,4- dibromo- 6- {[(1- methyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: Brc1cc(CNc2[nH+]c3c(n2C)cccc3)c(c(c1)Br)[O-]

STL037615
Synonyms: 5- (4- bromophenyl)- 7- (thiophen- 2- yl)- 1,5- dihydro[1,2,4]triazolo[4,3- a]pyrimidine
Smiles: Brc1ccc(cc1)C1C=C(N=c2n1cn[nH]2)c1cccs1

STL037622
Synonyms: 7- benzyl- 4- hydroxy- 1- phenyl- 5,5- bis(trifluoromethyl)- 5,8- dihydropyrimido[4,5- d]pyrimidin- 2(1H)- one
Smiles: O=c1nc(O)c2c(n1c1ccccc1)NC(=NC2(C(F)(F)F)C(F)(F)F)Cc1ccccc1

STL037625
Synonyms: 8- tert- butyl- 4- (4- methylphenyl)- 1- thioxo- 2,4,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(1H)- one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3CCC(Cc3sc2n2c1n[nH]c2=S)C(C)(C)C

STL037639
Synonyms: 5- (2- acetyl- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 1- (4- chlorophenyl)- 4,6- dihydroxypyrimidin- 2(1H)- one
Smiles: Clc1ccc(cc1)n1c(=O)nc(c(c1O)C1N(CCc2c1cccc2)C(=O)C)O

STL037641
Synonyms: (2E)- N- (2- {[2- (1H- benzimidazol- 2- yl)ethyl]amino}- 2- oxoethyl)- 3- (furan- 2- yl)prop- 2- enamide
Smiles: O=C(CNC(=O)/C=C/c1ccco1)NCCc1nc2c([nH]1)cccc2

STL037661
Synonyms: 6- (2- aminophenyl)- 3- sulfanyl- 1,2,4- triazin- 5- ol
Smiles: Sc1nnc(c(n1)O)c1ccccc1N

STL037663
Synonyms: (5E)- 2,6- dihydroxy- 5- {[5- (2- methoxy- 5- nitrophenyl)furan- 2- yl]methylidene}pyrimidin- 4(5H)- one
Smiles: COc1ccc(cc1c1ccc(o1)/C=C/1\C(=NC(=NC1=O)O)O)[N+](=O)[O-]

STL037664
Synonyms: [5- (2- hydroxy- 4- methylphenyl)- 1H- pyrazol- 4- yl](4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1cn[nH]c1c1ccc(cc1O)C

STL037682
Synonyms: (5Z)- 5- (1H- benzimidazol- 2- ylmethylidene)- 6- hydroxy- 3- (3- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: Cc1cccc(c1)N1C(=O)N=C(/C(=C/c2nc3c([nH]2)cccc3)/C1=O)O

STL037692
Synonyms: 1- cycloheptyl- 7- hydroxy- 4- (4- methylphenyl)- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: OC1=Nc2n([nH]c(=O)c2C(SC1)c1ccc(cc1)C)C1CCCCCC1

STL037693
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (thiophen- 2- yl)pyrrolidin- 3- ylidene](3- methoxyphenyl)methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)Cc1ccc[nH+]c1)/[O-]

STL037704
Synonyms: (E)- [2- (4- methoxyphenyl)- 1- (6- methylpyridinium- 2- yl)- 4,5- dioxopyrrolidin- 3- ylidene](thiophen- 2- yl)methanolate
Smiles: COc1ccc(cc1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1c1cccc([nH+]1)C

STL037709
Synonyms: (E)- (4- bromophenyl){2- (2,5- dimethoxyphenyl)- 1- [3- (dimethylammonio)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: COc1ccc(c(c1)C1/C(=C(/c2ccc(cc2)Br)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C)OC

STL037719
Synonyms: (5Z)- 5- [(2- hydroxy- 8- methylquinolin- 3- yl)methylidene]- 2- sulfanyl- 1,3- thiazol- 4(5H)- one
Smiles: Cc1cccc2c1nc(O)c(c2)/C=C/1\SC(=NC1=O)S

STL037725
Synonyms: 2- hydroxy- 4- [(Z)- (3- oxo[1,3]thiazolo[3,2- a]benzimidazol- 9- ium- 2(3H)- ylidene)methyl]phenolate
Smiles: [O-]c1ccc(cc1O)/C=c/1\sc2n(c1=O)c1c([nH+]2)cccc1

STL037731
Synonyms: 4- oxo- 4- [4- (4- phenylquinazolin- 2- yl)piperazin- 4- ium- 1- yl]butanoate
Smiles: [O-]C(=O)CCC(=O)N1CC[NH+](CC1)c1nc2ccccc2c(n1)c1ccccc1

STL037739
Synonyms: 3- [(6- methyl- 4- phenylquinazolin- 2- yl)ammonio]propanoate
Smiles: [O-]C(=O)CC[NH2+]c1nc2ccc(cc2c(n1)c1ccccc1)C

STL037750
Synonyms: 4- {[(4E)- 1- (4- methylphenyl)- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]amino}benzoicacid
Smiles: Cc1ccc(cc1)n1ncc2c1[nH]cn/c/2=N/c1ccc(cc1)C(=O)O

STL037752
Synonyms: (E)- (4- chlorophenyl)[4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (pyridin- 4- yl)pyrrolidin- 3- ylidene]methanolate
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)Cc1ccc[nH+]c1)/[O-]

STL037768
Synonyms: 2- ({5- [(4- methylphenoxy)methyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- N- [(2E)- 5- methyl- 4- phenyl- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: Cc1ccc(cc1)OCc1nnc(o1)SCC(=O)/N=c\1/sc(c([nH]1)c1ccccc1)C

STL037774
Synonyms: 8- {[4- (furan- 2- ylcarbonyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 3,9- dihydro- 1H- purine- 2,6- dione
Smiles: O=C(c1ccco1)N1CCN(CC1)Cc1nc2c([nH]1)n(C)c(=O)n(c2=O)C

STL037791
Synonyms: 2- (ethylsulfanyl)- 6- hydroxy- 4- (3- nitrophenyl)- 4,5- dihydropyridine- 3- carbonitrile
Smiles: CCSC1=C(C#N)C(CC(=N1)O)c1cccc(c1)[N+](=O)[O-]

STL037798
Synonyms: (5E)- 6- hydroxy- 5- [(1- phenyl- 1H- pyrazol- 4- yl)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1NC(=O)/C(=C/c2cnn(c2)c2ccccc2)/C(=N1)O

STL037805
Synonyms: (5Z)- 5- [(5- phenyl- 1H- pyrazol- 4- yl)methylidene]- 2- (piperidin- 1- yl)- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C\c1cn[nH]c1c1ccccc1)N1CCCCC1

STL037807
Synonyms: 6,6- dimethyl- 9- (2- methylphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2C)ncn3)CC(C1)(C)C

STL037808
Synonyms: 3- {[(4- ethoxyphenyl)amino]methyl}quinolin- 2(1H)- one
Smiles: CCOc1ccc(cc1)NCc1cc2ccccc2[nH]c1=O

STL037812
Synonyms: (E)- furan- 2- yl{1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- [4- (propan- 2- yloxy)phenyl]pyrrolidin- 3- ylidene}methanolate
Smiles: CC(Oc1ccc(cc1)C1/C(=C(/c2ccco2)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1)C

STL037816
Synonyms: 7- (3- methoxyphenyl)- 5- (4- methoxyphenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: COc1ccc(cc1)C1=CC(n2c(=N1)[nH]cn2)c1cccc(c1)OC

STL037817
Synonyms: 3- amino- 6- (3,4- dimethoxyphenyl)- N- [(2Z)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cc(ccc1OC)c1ccc2c(n1)sc(c2N)C(=O)/N=c/1\scc([nH]1)C

STL037826
Synonyms: 6- chloro- 3- (morpholin- 4- yl)- 4- phenylquinolin- 2- ol
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)N1CCOCC1

STL037849
Synonyms: 2- [(5- methyl- 1H- 1,2,4- triazol- 3- yl)sulfanyl]- N- (quinolin- 4- yl)acetamide
Smiles: O=C(Nc1ccnc2c1cccc2)CSc1n[nH]c(n1)C

STL037854
Synonyms: 8- tert- butyl- 2- (4- chlorophenyl)- 1,2,4- triazaspiro[4.5]dec- 3- ene- 3- thiol
Smiles: CC(C1CCC2(CC1)NN(C(=N2)S)c1ccc(cc1)Cl)(C)C

STL037855
Synonyms: 8- [(furan- 2- ylmethyl)amino]- 6- hydroxy- 7- [2- hydroxy- 3- (propan- 2- yloxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(Cn1c(NCc2ccco2)nc2c1c(O)nc(=O)n2C)COC(C)C

STL037863
Synonyms: 4- {[(2- chlorophenyl)carbonyl]amino}- 2- (5- ethyl- 1,3- benzoxazol- 3- ium- 2- yl)phenolate
Smiles: CCc1ccc2c(c1)[nH+]c(o2)c1cc(ccc1[O-])NC(=O)c1ccccc1Cl

STL037865
Synonyms: 6- hydroxy- 3- methyl- 7- (4- methylbenzyl)- 8- [(2E)- 2- (pyridin- 4- ylmethylidene)hydrazinyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1ccc(cc1)Cn1c(N/N=C/c2ccncc2)nc2c1c(O)nc(=O)n2C

STL037869
Synonyms: (5Z)- 2- (4- acetylpiperazin- 1- yl)- 5- [(5- phenyl- 1H- pyrazol- 4- yl)methylidene]- 1,3- thiazol- 4(5H)- one
Smiles: CC(=O)N1CCN(CC1)C1=NC(=O)/C(=C/c2cn[nH]c2c2ccccc2)/S1

STL037880
Synonyms: N'- {(E)- [1- (butan- 2- yl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}pyridine- 4- carbohydrazide
Smiles: CCC(N1C(=NC(=O)/C(=C\NNC(=O)c2ccncc2)/C1=O)S)C

STL037895
Synonyms: 3- [(Z)- 2- (2,4- dimethyl- 1,3- thiazol- 5- yl)- 2- hydroxyethenyl]- 6- methyl- 2H- 1,4- benzoxazin- 2- one
Smiles: Cc1sc(c(n1)C)/C(=C/c1nc2cc(C)ccc2oc1=O)/O

STL037898
Synonyms: 7- chloro- 5- phenyl- 4,5- dihydro- 3H- 1,4- benzodiazepin- 2- ol
Smiles: Clc1ccc2c(c1)C(NCC(=N2)O)c1ccccc1

STL037901
Synonyms: 3- hydroxy- N- (3- methoxyphenyl)- 1- oxo- 6,7- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1c(O)n2CCCc3c2c(c1=O)ccc3

STL037905
Synonyms: 4- {1- [2- (dimethylammonio)ethyl]- 4- hydroxy- 5- oxo- 3- (phenylcarbonyl)- 2,5- dihydro- 1H- pyrrol- 2- yl}phenolate
Smiles: C[NH+](CCN1C(c2ccc(cc2)[O-])C(=C(C1=O)O)C(=O)c1ccccc1)C

STL037913
Synonyms: 8- (azepan- 1- yl)- 7- [2- (1,3- benzoxazol- 2- ylsulfanyl)ethyl]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cn1c(=O)nc(c2c1nc(n2CCSc1nc2c(o1)cccc2)N1CCCCCC1)O

STL037914
Synonyms: 5- hydroxy- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyrimidin- 7- one
Smiles: O=c1cc(O)n2c(n1)SCC2

STL037915
Synonyms: 6- [(4- hydroxy- 6- methyl- 2- sulfanylpyrimidin- 5- yl)oxy]pyridazin- 3- ol
Smiles: Oc1ccc(nn1)Oc1c(C)nc(nc1O)S

STL037921
Synonyms: 1- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]pyrrolidinium
Smiles: OC(CN1C(=NC(C1=O)(C)C)O)C[NH+]1CCCC1

STL037922
Synonyms: (2E,5Z)- 5- (1H- indol- 3- ylmethylidene)- 2- (phenylimino)- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: OC1=N/C(=N\c2ccccc2)/S/C/1=C\c1c[nH]c2c1cccc2

STL037926
Synonyms: 1- [(2Z)- 1,3- benzoxazol- 2(3H)- ylidene]- 2- [(2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene)methyl]guanidine
Smiles: O=C1NC(=O)C(=C/N=C(/N=c/2\oc3c([nH]2)cccc3)\N)C(=O)N1

STL037930
Synonyms: 4- chloro- N- methyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: Clc1ccc(cc1)C(=O)N(Cc1cc2ccccc2[nH]c1=O)C

STL037942
Synonyms: 6- hydroxy- 5- [2- (pyridin- 2- yl)ethyl]pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1NC(=O)N=C(C1CCc1ccccn1)O

STL037954
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 6- hydroxy- 3- methyl- 7- (3- phenylpropyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCN1CCN(CC1)c1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

STL037970
Synonyms: 3- [(2,4- dichlorobenzyl)sulfonyl]- 5- propyl- 4H- 1,2,4- triazole
Smiles: CCCc1nnc([nH]1)S(=O)(=O)Cc1ccc(cc1Cl)Cl

STL037971
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 2- (4- nitrophenyl)- 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)[N+](=O)[O-])CCCn1c[nH+]cc1)/[O-]

STL037977
Synonyms: (E)- furan- 2- yl{1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- (3- propoxyphenyl)pyrrolidin- 3- ylidene}methanolate
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccco2)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL037996
Synonyms: N- (2- hydroxy- 6- methyl- 4- phenylquinolin- 3- yl)- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1c(O)nc2c(c1c1ccccc1)cc(cc2)C

STL038002
Synonyms: N'- [(E)- (3- fluorophenyl)methylidene]- 2,4- dihydroxy- 5,6,7,8- tetrahydroquinoline- 3- carbohydrazide
Smiles: Fc1cccc(c1)/C=N/NC(=O)c1c(O)nc2c(c1O)CCCC2

STL038005
Synonyms: 1- (1,3- benzothiazol- 2- yl)- 3- phenyl- 4- {(E)- [(tetrahydrofuran- 2- ylmethyl)imino]methyl}- 1H- pyrazol- 5- ol
Smiles: Oc1c(/C=N/CC2CCCO2)c(nn1c1nc2c(s1)cccc2)c1ccccc1

STL038011
Synonyms: 7- (3,4- dimethoxyphenyl)- 5- (4- methylphenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: COc1cc(ccc1OC)C1C=C(N=c2n1nc[nH]2)c1ccc(cc1)C

STL038012
Synonyms: (2Z)- 3- (1H- benzotriazol- 1- yl)- 4- hydroxy- 2- (phenylimino)naphthalen- 1(2H)- one
Smiles: O=C1c2ccccc2C(=C(/C/1=N/c1ccccc1)n1nnc2c1cccc2)O

STL038013
Synonyms: 2,4- dichloro- 6- {[(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)ammonio]methyl}phenolate
Smiles: Clc1cc(Cl)c(c(c1)C[NH2+]c1c(=O)n(n(c1C)C)c1ccccc1)[O-]

STL038018
Synonyms: N- (4- acetylphenyl)- 2- {[3- cyano- 5- hydroxy- 4- (2- methylphenyl)- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C(=O)C)N=C2C(=C(O)CCC2)C1c1ccccc1C

STL038024
Synonyms: (E)- [2- (3,4- dimethoxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](phenyl)methanolate
Smiles: COc1ccc(cc1OC)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL038028
Synonyms: 4- {[(E)- (3- hydroxyphenyl)methylidene]amino}- 5- (pyridin- 4- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Oc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccncc1

STL038037
Synonyms: (6Z)- 6- [(2E)- (4- ethoxybenzylidene)hydrazinylidene]- 5,6- dihydro[1,2,4]triazolo[3,4- a]phthalazine
Smiles: CCOc1ccc(cc1)/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2

STL038046
Synonyms: 6- hydroxy- 5- [2- (4- methoxyphenyl)ethyl]- 5- [2- (pyridin- 4- yl)ethyl]- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: COc1ccc(cc1)CCC1(CCc2ccncc2)C(=NC(=NC1=O)S)O

STL038048
Synonyms: 4- benzyl- 4- hydroxy- 3- methyl- 2,6- diphenylpiperidinium
Smiles: CC1C([NH2+]C(CC1(O)Cc1ccccc1)c1ccccc1)c1ccccc1

STL038079
Synonyms: {2- [(E)- (2- {[4- (4- chlorobenzyl)piperazin- 1- ium- 1- yl]acetyl}hydrazinylidene)methyl]phenoxy}acetate
Smiles: [O-]C(=O)COc1ccccc1/C=N/NC(=O)C[NH+]1CCN(CC1)Cc1ccc(cc1)Cl

STL038084
Synonyms: 6- hydroxy- 3- methyl- 7- (naphthalen- 1- ylmethyl)- 8- [(2- phenylethyl)amino]- 3,7- dihydro- 2H- purin- 2- one
Smiles: O=c1nc(O)c2c(n1C)nc(n2Cc1cccc2c1cccc2)NCCc1ccccc1

STL038090
Synonyms: (5Z)- 3- (4- fluorophenyl)- 6- hydroxy- 5- {[1- (3- phenoxypropyl)- 1H- pyrrol- 2- yl]methylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)N=C(/C(=C/c2cccn2CCCOc2ccccc2)/C1=O)O

STL038096
Synonyms: 7- ({3- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]propyl}amino)- 2- methyl- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc2c(c1)[nH]c1c(o2)cc(c2c1c(=O)c1c(c2=O)cccc1)NCCCN1CCN(CC1)Cc1ccc2c(c1)OCO2

STL038097
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- phenylpyrrolidin- 3- ylidene}(phenyl)methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccccc2)/[O-])/C(N1CCCn1c[nH+]cc1)c1ccccc1

STL038112
Synonyms: 7- bromo- 5- (4- chlorophenyl)- 3H- 1,4- benzodiazepine- 2,3- diol
Smiles: Clc1ccc(cc1)C1=NC(O)C(=Nc2c1cc(Br)cc2)O

STL038117
Synonyms: N'- [(E)- (2- fluorophenyl)methylidene]- 2,4- dihydroxy- 5,6,7,8- tetrahydroquinoline- 3- carbohydrazide
Smiles: O=C(c1c(O)nc2c(c1O)CCCC2)N/N=C/c1ccccc1F

STL038118
Synonyms: 5- benzyl- N- [(2E)- 4,6,7- trimethylquinazolin- 2(1H)- ylidene]- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: Cc1cc2c(C)n/c(=N/C3=NCN(CN3)Cc3ccccc3)/[nH]c2cc1C

STL038128
Synonyms: {2- [(E)- {1- [2- (4- fluorophenyl)ethyl]- 2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene}methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccccc1/C=C/1\C(=O)N=C(N(C1=O)CCc1ccc(cc1)F)O

STL038135
Synonyms: 3- hydroxy- 4- [(Z)- (4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)methyl]naphthalene- 2- carboxylicacid
Smiles: O=C1NC(=O)/C(=C\c2c(O)c(cc3c2cccc3)C(=O)O)/C(=N1)O

STL038143
Synonyms: N- butyl- 3,4,5- triethoxy- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: CCCCN(C(=O)c1cc(OCC)c(c(c1)OCC)OCC)Cc1cc2cc(OC)ccc2[nH]c1=O

STL038145
Synonyms: 1- (1,3- benzothiazol- 2- yl)- 3- methyl- 4- {(1Z)- N- [3- (morpholin- 4- yl)propyl]ethanimidoyl}- 1H- pyrazol- 5- ol
Smiles: C/C(=N/CCCN1CCOCC1)/c1c(C)nn(c1O)c1nc2c(s1)cccc2

STL038148
Synonyms: 4- {(3E)- 2- (2- fluorophenyl)- 3- [hydroxy(phenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}butanoicacid
Smiles: OC(=O)CCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1F

STL038160
Synonyms: (E)- [2- (4- chlorophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](3- methoxyphenyl)methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)Cc1ccc[nH+]c1)/[O-]

STL038161
Synonyms: (5Z)- 5- (4- fluorobenzylidene)- 6- hydroxy- 3- (4- methoxybenzyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)CN1C(=O)N=C(/C(=C/c2ccc(cc2)F)/C1=O)O

STL038162
Synonyms: N- (2- {2- [(Z)- (1- cyclopropyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]- 1H- indol- 3- yl}ethyl)heptanamide
Smiles: CCCCCCC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)C2CC2)S)[nH]c2c1cccc2

STL038164
Synonyms: 5- (4- bromophenyl)- 7- (2,4- dichlorophenyl)- 3,7- dihydrotetrazolo[1,5- a]pyrimidine
Smiles: Brc1ccc(cc1)C1=CC(n2c(=N1)[nH]nn2)c1ccc(cc1Cl)Cl

STL038169
Synonyms: 2- ethyl- 6,6- dimethyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine- 4- thione
Smiles: CCc1nc2sc3c(c2c(=S)[nH]1)CC(OC3)(C)C

STL038177
Synonyms: 4- (2,4- dimethoxyphenyl)- 5- phenyl- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)ccc1n1c(=S)[nH]nc1c1ccccc1

STL038178
Synonyms: 3- phenyl- 1- [(Z)- [(phenylcarbamoyl)amino]{[(2Z)- 4,6,7- trimethylquinazolin- 2(3H)- ylidene]amino}methylidene]urea(non- preferredname)
Smiles: O=C(N/C(=N/C(=O)Nc1ccccc1)/N=c\1/[nH]c(C)c2c(n1)cc(c(c2)C)C)Nc1ccccc1

STL038185
Synonyms: 1- (butan- 2- yl)- 4- (4- fluorophenyl)- 7- hydroxy- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: CCC(n1[nH]c(=O)c2c1N=C(O)CSC2c1ccc(cc1)F)C

STL038191
Synonyms: 8- methyl- 5H- [1,2,4]triazino[5,6- b]indole- 3- thiol
Smiles: Cc1ccc2c(c1)c1nnc(nc1[nH]2)S

STL038200
Synonyms: 4- {[(2Z)- 3- [(thiophen- 2- ylsulfonyl)amino]quinoxalin- 2(1H)- ylidene]amino}benzoicacid
Smiles: OC(=O)c1ccc(cc1)/N=c/1\[nH]c2ccccc2nc1NS(=O)(=O)c1cccs1

STL038203
Synonyms: N- [2- (2- {(Z)- [1- (4- bromophenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 1H- indol- 3- yl)ethyl]acetamide
Smiles: CC(=O)NCCc1c(/C=C\2/C(=NC(=O)N(C2=O)c2ccc(cc2)Br)O)[nH]c2c1cccc2

STL038210
Synonyms: (5Z)- 5- (3- ethoxy- 4- hydroxybenzylidene)- 6- hydroxy- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: CCOc1cc(ccc1O)/C=C\1/C(=NC(=NC1=O)S)O

STL038211
Synonyms: methyl(2E)- [(2E)- 2- [(4,6- dimethylpyrimidin- 2- yl)imino]- 3- (4- methoxyphenyl)- 5- oxoimidazolidin- 4- ylidene]ethanoate
Smiles: COC(=O)/C=C/1\C(=O)N/C(=N\c2nc(C)cc(n2)C)/N1c1ccc(cc1)OC

STL038213
Synonyms: (3Z)- 4- hydroxy- N,4- bis(4- methoxyphenyl)- 2- oxobut- 3- enamide
Smiles: COc1ccc(cc1)NC(=O)C(=O)/C=C(/c1ccc(cc1)OC)\O

STL038218
Synonyms: 5- (2,4- dimethoxybenzyl)- 6- hydroxy- 2- oxo- 2,3- dihydropyrimidin- 4- olate
Smiles: COc1cc(OC)ccc1Cc1c(O)nc(=O)[nH]c1[O-]

STL038224
Synonyms: (6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl3- methylbutanoate
Smiles: CC(CC(=O)OCc1cc2cc(C)ccc2[nH]c1=O)C

STL038227
Synonyms: 4- [(dimethylammonio)methyl]- 3- (ethoxycarbonyl)- 2- methyl- 1- benzofuran- 5- olate
Smiles: CCOC(=O)c1c(C)oc2c1c(C[NH+](C)C)c(cc2)[O-]

STL038239
Synonyms: N- [N'- (2- bromophenyl)- N- (4,6- dimethylpyrimidin- 2- yl)carbamimidoyl]- 2- (1,3- dioxooctahydro- 2H- isoindol- 2- yl)- 3- phenylpropanamide
Smiles: Cc1cc(C)nc(n1)N/C(=N/c1ccccc1Br)/NC(=O)C(N1C(=O)C2C(C1=O)CCCC2)Cc1ccccc1

STL038241
Synonyms: 5- cyclohexyl- 2- [(2- ethoxyethyl)sulfanyl]- 5- methyl- 5,6- dihydrobenzo[h]quinazolin- 4- ol
Smiles: CCOCCSc1nc(O)c2c(n1)c1ccccc1CC2(C)C1CCCCC1

STL038257
Synonyms: N- [(E)- amino{[(2E)- 6- ethyl- 4- methylquinazolin- 2(3H)- ylidene]amino}methylidene]- 2- (methylamino)benzamide
Smiles: CCc1ccc2c(c1)c(C)[nH]/c(=N\C(=N\C(=O)c1ccccc1NC)\N)/n2

STL038260
Synonyms: methyl2- [(6- hydroxy- 3- methyl- 2- oxo- 7- pentyl- 3,7- dihydro- 2H- purin- 8- yl)sulfanyl]propanoate
Smiles: CCCCCn1c(SC(C(=O)OC)C)nc2c1c(O)nc(=O)n2C

STL038272
Synonyms: 6- (ethylsulfonyl)- 3- [(Z)- 2- hydroxy- 2- (4- methylphenyl)ethenyl]- 2H- 1,4- benzoxazin- 2- one
Smiles: CCS(=O)(=O)c1ccc2c(c1)nc(c(=O)o2)/C=C(/c1ccc(cc1)C)\O

STL038275
Synonyms: 2- {4- [(2- hydroxyethyl)ammonio]- 6- methylpyrimidin- 2- yl}phenolate
Smiles: OCC[NH2+]c1cc(C)nc(n1)c1ccccc1[O-]

STL038281
Synonyms: N- (3- methoxyphenyl)- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]thiophene- 2- carboxamide
Smiles: COc1cccc(c1)N(C(=O)c1cccs1)Cc1cc2ccc(cc2[nH]c1=O)C

STL038299
Synonyms: 3- {[(2Z)- 3- [(thiophen- 2- ylsulfonyl)amino]quinoxalin- 2(1H)- ylidene]amino}benzoicacid
Smiles: OC(=O)c1cccc(c1)/N=c/1\[nH]c2ccccc2nc1NS(=O)(=O)c1cccs1

STL038313
Synonyms: (5E)- 1- butyl- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCCCN1C(=NC(=O)/C(=C\NCCCn2ccnc2)/C1=O)S

STL038319
Synonyms: N- [(E)- 2- (furan- 2- yl)- 1- (5- sulfanyl- 4H- 1,2,4- triazol- 3- yl)ethenyl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)N/C(=C/c1ccco1)/c1nnc([nH]1)S

STL038321
Synonyms: 2- (5- {(Z)- [4,6- dioxo- 1- (prop- 2- en- 1- yl)- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 2- methoxybenzyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: C=CCN1C(=NC(=O)/C(=C/c2ccc(c(c2)CN2C(=O)c3c(C2=O)cccc3)OC)/C1=O)S

STL038322
Synonyms: (E)- (2,8- dimethylimidazo[1,2- a]pyridin- 3- yl){1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxo- 2- (thiophen- 2- yl)pyrrolidin- 3- ylidene}methanolate
Smiles: O=C1C(=O)N(C(/C/1=C(/c1c(C)nc2n1cccc2C)\[O-])c1cccs1)CC[NH+]1CCOCC1

STL038324
Synonyms: 2- chloro- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylphenyl)benzamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(c1ccccc1C)C(=O)c1ccccc1Cl

STL038327
Synonyms: (6Z)- 6- [(2E)- (3- methoxybenzylidene)hydrazinylidene]- 5,6- dihydro[1,2,4]triazolo[3,4- a]phthalazine
Smiles: COc1cccc(c1)/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2

STL038330
Synonyms: 4- [3- (pyrazin- 2- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)n1c(n[nH]c1=S)c1nccnc1

STL038341
Synonyms: (5Z)- 5- [(1- ethyl- 2,3- dihydro- 1H- indol- 5- yl)methylidene]- 6- hydroxy- 3- (3- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CCN1CCc2c1ccc(c2)/C=C\1/C(=NC(=O)N(C1=O)c1cccc(c1)C)O

STL038357
Synonyms: 1- cyclohexyl- 3- [(2Z)- 5- ethyl- 4- oxo- 1,3- thiazolidin- 2- ylidene]urea
Smiles: CCC1S/C(=N\C(=O)NC2CCCCC2)/NC1=O

STL038361
Synonyms: 3- [(Z)- 2- (3,4- dimethoxyphenyl)- 2- hydroxyethenyl]- 7- nitro- 2H- 1,4- benzoxazin- 2- one
Smiles: COc1ccc(cc1OC)/C(=C/c1nc2ccc(cc2oc1=O)[N+](=O)[O-])/O

STL038362
Synonyms: 5- (2,3- dichlorobenzyl)- 2,6- dihydroxy- 5- [2- (pyridin- 4- yl)ethyl]pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)C(C(=N1)O)(CCc1ccncc1)Cc1cccc(c1Cl)Cl

STL038368
Synonyms: (5E)- 5- [(azepan- 1- ylamino)methylidene]- 1- phenyl- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NN1CCCCCC1)c1ccccc1

STL038370
Synonyms: (5Z)- 3- (3- chlorophenyl)- 6- hydroxy- 5- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: Clc1cccc(c1)N1C(=O)N=C(/C(=C/NCCCN2CCOCC2)/C1=O)O

STL038378
Synonyms: 4- chloro- N- (3- methoxyphenyl)- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: COc1cccc(c1)N(C(=O)c1ccc(cc1)Cl)Cc1cc2cc(C)ccc2[nH]c1=O

STL038390
Synonyms: 5- [(E)- {2- [(1,3- benzothiazol- 3- ium- 2- ylsulfanyl)acetyl]hydrazinylidene}methyl]- 2- hydroxyphenolate
Smiles: O=C(CSc1sc2c([nH+]1)cccc2)N/N=C/c1ccc(c(c1)[O-])O

STL038398
Synonyms: 4- {(E)- [5- iminio- 7- oxo- 2- (pyridin- 3- yl)- 5H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 6(7H)- ylidene]methyl}phenolate
Smiles: [O-]c1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=[NH2+])nc(s2)c1cccnc1

STL038400
Synonyms: 3- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 2- hydroxy- 7- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)[nH]c1c2nc(n(c1=O)/N=C/c1ccc(c(c1)OC)OC)O

STL038409
Synonyms: 2- amino- 3- carbamoyl- 1- (4- nitrophenyl)- 5H- pyrido[3,2- b]indol- 1- ium
Smiles: NC(=O)c1cc2[nH]c3c(c2[n+](c1N)c1ccc(cc1)[N+](=O)[O-])cccc3

STL038415
Synonyms: N- methyl- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]tetrahydrofuran- 2- carboxamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)C1CCCO1)C

STL038424
Synonyms: (5Z)- 6- hydroxy- 3- (2- phenylethyl)- 5- ({[2- (piperazin- 1- yl)ethyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/NCCN2CCNCC2)/C(=O)N1CCc1ccccc1

STL038456
Synonyms: (5Z)- 5- [(2- hydroxyquinolin- 3- yl)methylidene]- 2- sulfanyl- 1,3- thiazol- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C/c2cc3ccccc3nc2O)/S1

STL038460
Synonyms: 4- ({(Z)- [1- (3,4- dimethylphenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}amino)benzoicacid
Smiles: O=C1N=C(O)/C(=C/Nc2ccc(cc2)C(=O)O)/C(=O)N1c1ccc(c(c1)C)C

STL038474
Synonyms: (2E)- N- [2- (1H- benzimidazol- 2- yl)ethyl]- 3- (furan- 2- yl)prop- 2- enamide
Smiles: O=C(/C=C/c1ccco1)NCCc1nc2c([nH]1)cccc2

STL038478
Synonyms: (E)- {2- (furan- 2- yl)- 1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}(3- methoxyphenyl)methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)CCCn1cc[nH+]c1)/[O-]

STL038479
Synonyms: (E)- (2,4- dimethyl- 1,3- thiazol- 5- yl){1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxo- 2- [4- (propan- 2- yl)phenyl]pyrrolidin- 3- ylidene}methanolate
Smiles: Cc1nc(c(s1)/C(=C\1/C(c2ccc(cc2)C(C)C)N(C(=O)C1=O)CCC[NH+]1CCOCC1)/[O-])C

STL038488
Synonyms: 2- {2- methoxy- 5- [(Z)- (1- methyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]benzyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)N=C(N(C1=O)C)S

STL038494
Synonyms: (5Z)- 3- (furan- 2- ylmethyl)- 6- hydroxy- 5- ({1- [2- oxo- 2- (pyrrolidin- 1- yl)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/c2cn(c3c2cccc3)CC(=O)N2CCCC2)/C(=O)N1Cc1ccco1

STL038496
Synonyms: 5',6',7',8'- tetrahydro- 3'H- spiro[cyclohexane- 1,9'- tetrazolo[5,1- b]quinazoline]
Smiles: C1CCC2(CC1)C1=C(CCCC1)N=c1n2nn[nH]1

STL038508
Synonyms: 1- (carboxymethyl)piperidinium
Smiles: OC(=O)C[NH+]1CCCCC1

STL038510
Synonyms: N- [(2E)- 5- methyl- 4- oxo- 1,3- thiazolidin- 2- ylidene]furan- 2- carboxamide
Smiles: O=C1N/C(=N\C(=O)c2ccco2)/SC1C

STL038511
Synonyms: 5- (pyridin- 3- yl)- 4- ({(E)- [4- (trifluoromethyl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1/N=C/c1ccc(cc1)C(F)(F)F)c1cccnc1

STL038518
Synonyms: (E)- {2- (4- fluorophenyl)- 1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}(furan- 2- yl)methanolate
Smiles: Fc1ccc(cc1)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1ccco1)/[O-]

STL038525
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 1- ethyl- 2- hydroxy- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: COc1cc(CCNC(=O)c2c(O)n(CC)c3c(c2=O)cccc3)ccc1OC

STL038526
Synonyms: N- [(2E)- 4- hydroxy- 1,3- thiazol- 2(5H)- ylidene]- 4- methylbenzenesulfonamide
Smiles: OC1=N/C(=N\S(=O)(=O)c2ccc(cc2)C)/SC1

STL038527
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- phenylpyrrolidin- 3- ylidene}[4- (prop- 2- en- 1- yloxy)phenyl]methanolate
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCCn1c[nH+]cc1)/[O-]

STL038546
Synonyms: 4- [5- (4- bromophenyl)- 3- (2- hydroxy- 6- methyl- 4- phenylquinolin- 3- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)Br)c1c(O)nc2c(c1c1ccccc1)cc(cc2)C

STL038549
Synonyms: 2- [(1E)- 1- (2- {[4- (4- methylbenzyl)piperazin- 1- ium- 1- yl]acetyl}hydrazinylidene)ethyl]phenolate
Smiles: O=C(C[NH+]1CCN(CC1)Cc1ccc(cc1)C)N/N=C(/c1ccccc1[O-])\C

STL038551
Synonyms: (5E)- 5- ({[3- (diethylamino)propyl]amino}methylidene)- 3- (2,4- dimethylphenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCN(CCCN/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1C)C)O)CC

STL038563
Synonyms: (E)- (4- chlorophenyl)[2- (4- methylphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: Cc1ccc(cc1)C1N(Cc2ccc[nH+]c2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)Cl)/[O-]

STL038564
Synonyms: 1- (6- hydroxy- 3- methyl- 7- {2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]ethyl}- 2- oxo- 3,7- dihydro- 2H- purin- 8- yl)piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)c1nc2c(n1CCSc1nnc(s1)C)c(O)nc(=O)n2C

STL038582
Synonyms: 2- hydroxy- 1- methyl- 4- oxo- N'- [(E)- pyridin- 4- ylmethylidene]- 1,4- dihydroquinoline- 3- carbohydrazide
Smiles: O=C(c1c(O)n(C)c2c(c1=O)cccc2)N/N=C/c1ccncc1

STL038602
Synonyms: (E)- {4,5- dioxo- 2- [3- (prop- 2- en- 1- yloxy)phenyl]- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene}(thiophen- 2- yl)methanolate
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL038629
Synonyms: (E)- (4- chlorophenyl)[2- (4- nitrophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1ccc[nH+]c1)/[O-]

STL038637
Synonyms: 1- (4,6- dimethylpyrimidin- 2- yl)- 2- (2- methoxy- 5- methylphenyl)guanidine
Smiles: COc1ccc(cc1/N=C(/Nc1nc(C)cc(n1)C)\N)C

STL038660
Synonyms: (5Z)- 5- [(1- ethyl- 2,3- dihydro- 1H- indol- 5- yl)methylidene]- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CCN1CCc2c1ccc(c2)/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O

STL038664
Synonyms: 2- [(1,4- dioxaspiro[4.5]dec- 2- ylmethyl)sulfanyl]- 6- methylpyrimidin- 4- ol
Smiles: Cc1nc(SCC2COC3(O2)CCCCC3)nc(c1)O

STL038686
Synonyms: 4,6- dichloro- 3- [2- (3,5- dimethyl- 1H- pyrazol- 4- yl)- 2- oxoethyl]- 3- hydroxy- 1,3- dihydro- 2H- indol- 2- one
Smiles: Clc1cc(Cl)c2c(c1)NC(=O)C2(O)CC(=O)c1c(C)n[nH]c1C

STL038690
Synonyms: 4- hydroxy- 6- oxo- N- (pyridin- 3- yl)- 1,2- dihydro- 6H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: O=C(c1c(=O)c2cccc3c2n(c1O)CC3)Nc1cccnc1

STL038737
Synonyms: 7- phenyl- 6,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 5(3H)- one
Smiles: O=C1CC(c2ccccc2)n2c(=N1)[nH]cn2

STL038739
Synonyms: (5E)- 1- (4- methoxyphenyl)- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C\c2cccn2C)/C1=O)S

STL038745
Synonyms: N- [(2- hydroxy- 6- methyl- 4- phenylquinolin- 3- yl)methyl]- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)NCc1c(O)nc2c(c1c1ccccc1)cc(cc2)C

STL038768
Synonyms: N- (2- hydroxyethyl)- 4- {[(4- hydroxyquinazolin- 2- yl)sulfanyl]methyl}benzamide
Smiles: OCCNC(=O)c1ccc(cc1)CSc1nc(O)c2c(n1)cccc2

STL038774
Synonyms: 5- [(E)- (4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)methyl]furan- 2- sulfonate
Smiles: O=C1NC(=O)/C(=C/c2ccc(o2)S(=O)(=O)[O-])/C(=N1)O

STL038778
Synonyms: 5- cyclohexyl- 4- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1OC)/C=N/n1c(=S)[nH]nc1C1CCCCC1

STL038783
Synonyms: 1- [N'- (4,6- dimethylpyrimidin- 2- yl)carbamimidoyl]piperidine- 4- carboxamide
Smiles: N/C(=N\c1nc(C)cc(n1)C)/N1CCC(CC1)C(=O)N

STL038787
Synonyms: 2- [(E)- {2- [6- methyl- 2- (morpholin- 4- yl)pyrimidin- 3- ium- 4- yl]hydrazinylidene}methyl]phenolate
Smiles: Cc1cc(N/N=C/c2ccccc2[O-])[nH+]c(n1)N1CCOCC1

STL038796
Synonyms: 2- {[3- cyano- 4- (4- fluorophenyl)- 6- hydroxy- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)N=C(CC1c1ccc(cc1)F)O

STL038798
Synonyms: 2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)- N,N- di(propan- 2- yl)propan- 1- aminium
Smiles: OC(CN1C(=NC(C1=O)(C)C)O)C[NH+](C(C)C)C(C)C

STL038806
Synonyms: 3- methyl- N- [(2Z)- 4- (4- methylphenyl)- 1,3- thiazol- 2(3H)- ylidene]- 1- benzofuran- 2- carboxamide
Smiles: Cc1ccc(cc1)c1cs/c(=N\C(=O)c2oc3c(c2C)cccc3)/[nH]1

STL038809
Synonyms: 7- (4- chlorophenyl)- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: CC1=CC(c2ccc(cc2)Cl)n2c(=N1)[nH]cn2

STL038810
Synonyms: (E)- {1- [2- (dimethylammonio)ethyl]- 2- (4- ethoxy- 3- methoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(thiophen- 2- yl)methanolate
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STL038813
Synonyms: 4- [(dimethylammonio)methyl]- 6- oxo- 6,7,8,9,10,11- hexahydrocyclohepta[c]chromen- 3- olate
Smiles: C[NH+](Cc1c([O-])ccc2c1oc(=O)c1c2CCCCC1)C

STL038818
Synonyms: N- [(2E)- 6- ethoxy- 4- methylquinazolin- 2(3H)- ylidene]- 4- methyl- 6- phenylpyrimidin- 2- amine
Smiles: CCOc1ccc2c(c1)c(C)[nH]/c(=N\c1nc(C)cc(n1)c1ccccc1)/n2

STL038819
Synonyms: 4- (4- fluorophenyl)- 7- hydroxy- 1- (propan- 2- yl)- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: Fc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C(C)C)O

STL038835
Synonyms: 1- (3- methylphenyl)- 3- [(2Z)- 4- oxo- 6- propyl- 3,4- dihydropyrimidin- 2(1H)- ylidene]guanidine
Smiles: CCCc1cc(=O)[nH]/c(=N\C(=N)Nc2cccc(c2)C)/[nH]1

STL038865
Synonyms: 7- bromo- 5- (2- chlorophenyl)- 2- hydroxy- 3H- 1,4- benzodiazepin- 3- ylbenzoate
Smiles: Brc1ccc2c(c1)C(=NC(C(=N2)O)OC(=O)c1ccccc1)c1ccccc1Cl

STL038878
Synonyms: 3- [(E)- (tert- butylimino)methyl]- 6- methylquinolin- 2(1H)- one
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)/C=N/C(C)(C)C

STL038880
Synonyms: N,2- dimethyl- 5- [(4Z)- 4- ({4- [2- oxo- 2- (4- phenylpiperazin- 1- yl)ethoxy]phenyl}imino)- 3,4- dihydrophthalazin- 1- yl]benzenesulfonamide
Smiles: CNS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N\c2ccc(cc2)OCC(=O)N2CCN(CC2)c2ccccc2)/c2c1cccc2

STL038882
Synonyms: 6- benzyl- 5- hydroxy- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyrimidin- 7- one
Smiles: O=c1nc2SCCn2c(c1Cc1ccccc1)O

STL038891
Synonyms: (E)- [2- (2- fluorophenyl)- 4,5- dioxo- 1- (pyrimidin- 1- ium- 2- yl)pyrrolidin- 3- ylidene](5- methylfuran- 2- yl)methanolate
Smiles: Cc1ccc(o1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)c1nccc[nH+]1)/[O-]

STL038892
Synonyms: (5Z)- 5- (4- bromobenzylidene)- 3- (2,3,4,6- tetra- O- acetylhexopyranosyl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CC(=O)OCC1OC(C(C(C1OC(=O)C)OC(=O)C)OC(=O)C)N1C(=S)S/C(=C\c2ccc(cc2)Br)/C1=O

STL038896
Synonyms: 2- (5- methyl- 1,3- benzoxazol- 3- ium- 2- yl)- 4- {[(2- methylphenyl)carbonyl]amino}phenolate
Smiles: Cc1ccc2c(c1)[nH+]c(o2)c1cc(ccc1[O-])NC(=O)c1ccccc1C

STL038899
Synonyms: (E)- (3,4- dimethoxyphenyl)[4,5- dioxo- 2- phenyl- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1ccc(cc1OC)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)Cc1ccc[nH+]c1)/[O-]

STL038923
Synonyms: 4- ({[5- (4- tert- butylphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 2- ium- 3- yl]sulfanyl}methyl)benzoate
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)C(=O)[O-])[nH+]nc1c1ccc(cc1)C(C)(C)C

STL038927
Synonyms: pentyl(2,4- dihydroxyquinolin- 3- yl)acetate
Smiles: CCCCCOC(=O)Cc1c(O)nc2c(c1O)cccc2

STL038928
Synonyms: methyl4- [1- hydroxy- 3,3- dimethyl- 10- (phenylcarbonyl)- 3,4,10,11- tetrahydro- 2H- dibenzo[b,e][1,4]diazepin- 11- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1ccccc1)cccc2)(C)C

STL038932
Synonyms: 5,5'- (piperazinediium- 1,4- diyldimethanediyl)difuran- 2- carboxylate
Smiles: [O-]C(=O)c1ccc(o1)C[NH+]1CC[NH+](CC1)Cc1ccc(o1)C(=O)[O-]

STL038937
Synonyms: 2- fluoro- N- [4- hydroxy- 1- methyl- 2,6- dioxo- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]benzamide
Smiles: O=C1Nc2c(C1(NC(=O)c1ccccc1F)C(F)(F)F)c(O)nc(=O)n2C

STL038946
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 2- (4- methylphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(phenyl)methanolate
Smiles: Cc1ccc(cc1)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1ccccc1)/[O-]

STL038949
Synonyms: 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 2- hydroxy- 9- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cccc2c1c1nc(O)n(c(=O)c1[nH]2)/N=C/c1ccccc1F

STL038954
Synonyms: (E)- {2- (5- methylfuran- 2- yl)- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}(4- methylphenyl)methanolate
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccc(o2)C)N(C(=O)C1=O)CCC[NH+]1CCOCC1)/[O-]

STL038959
Synonyms: N- (5- chloro- 2- methoxyphenyl)- 4- hydroxy- 6- oxo- 1,2- dihydro- 6H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: COc1ccc(cc1NC(=O)c1c(=O)c2cccc3c2n(c1O)CC3)Cl

STL038968
Synonyms: 4- {(E)- [(3,5- dimethyl- 4H- 1,2,4- triazol- 1- ium- 4- yl)imino]methyl}phenolate
Smiles: [O-]c1ccc(cc1)/C=N/n1c(C)n[nH+]c1C

STL039004
Synonyms: 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5- ({1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 4- hydroxy- 6- oxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5- yl}[4- methoxy- 3- (piperidinium- 1- ylmethyl)phenyl]methyl)- 4- hydroxy- 6- oxo- 1,6- dihydr
Smiles: COc1ccc(cc1C[NH+]1CCCCC1)C(c1c(O)nc(n(c1=O)CCC1=CCCCC1)S)c1c(O)nc(n(c1=O)CCC1=CCCCC1)[S-]

STL039018
Synonyms: N- [(2E)- 5- {2- [(2E)- 2- (4- hydroxy- 3- methoxybenzylidene)hydrazinyl]- 2- oxoethyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: COc1cc(/C=N/NC(=O)Cc2n[nH]/c(=N\C(=O)c3ccccc3)/s2)ccc1O

STL039026
Synonyms: 4- [5- thioxo- 3- (3,4,5- trimethoxyphenyl)- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzoicacid
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1c1ccc(cc1)C(=O)O

STL039030
Synonyms: 4- [4- (6- methyl- 4- phenylquinazolin- 2- yl)piperazin- 4- ium- 1- yl]- 4- oxobutanoate
Smiles: [O-]C(=O)CCC(=O)N1CC[NH+](CC1)c1nc2ccc(cc2c(n1)c1ccccc1)C

STL039046
Synonyms: ethyl2- imino- 2,3- dihydro- 1,3- thiazole- 4- carboxylate
Smiles: CCOC(=O)c1csc(=N)[nH]1

STL039052
Synonyms: 7- (2- chlorobenzyl)- 8- [(furan- 2- ylmethyl)amino]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Clc1ccccc1Cn1c(NCc2ccco2)nc2c1c(O)nc(=O)n2C

STL039074
Synonyms: (5E)- 6- hydroxy- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C\NCCCn2cncc2)/C1=O)O

STL039075
Synonyms: (2E,5Z)- 5- (2- methoxybenzylidene)- 2- (phenylimino)- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: COc1ccccc1/C=C/1\S/C(=N/c2ccccc2)/N=C1O

STL039090
Synonyms: 4- {3- acetyl- 4- hydroxy- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 5- oxo- 2,5- dihydro- 1H- pyrrol- 2- yl}- 2- methoxyphenolate
Smiles: COc1cc(ccc1[O-])C1N(CCC[NH+]2CCOCC2)C(=O)C(=C1C(=O)C)O

STL039095
Synonyms: 2- {[2- (morpholin- 4- yl)ethyl]sulfanyl}- 5- phenylpyrimidine- 4,6- diol
Smiles: Oc1nc(SCCN2CCOCC2)nc(c1c1ccccc1)O

STL039096
Synonyms: (4E)- 4- {[2- (trifluoromethyl)phenyl]imino}- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1nc[nH]/c(=N\c2ccccc2C(F)(F)F)/n1

STL039110
Synonyms: 2- {(6Z)- 6- [(2- chlorophenyl)imino]- 4- methyl- 1,6- dihydropyrimidin- 2- yl}phenol
Smiles: Cc1c/c(=N/c2ccccc2Cl)/[nH]c(n1)c1ccccc1O

STL039113
Synonyms: (E)- {2- (4- chlorophenyl)- 1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}(5- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methanolate
Smiles: Clc1ccc(cc1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cnn(c1C)c1ccccc1)/[O-]

STL039116
Synonyms: 1- (2,4- dichlorophenyl)- 3- [(2E)- 5- (2- fluorobenzyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: Clc1ccc(c(c1)Cl)NC(=O)/N=c/1\[nH]nc(s1)Cc1ccccc1F

STL039139
Synonyms: 4- {[(E)- (2,4- dimethoxyphenyl)methylidene]amino}- 5- (pyridin- 4- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)ccc1/C=N/n1c(=S)[nH]nc1c1ccncc1

STL039147
Synonyms: 8- bromo- 7- (2- ethoxyethyl)- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cn1c2nc(n(c2c(nc1=O)O)CCOCC)Br

STL039165
Synonyms: N- cyclopentyl- 2,4- dihydroxy- 5,6,7,8- tetrahydroquinoline- 3- carboxamide
Smiles: O=C(c1c(O)nc2c(c1O)CCCC2)NC1CCCC1

STL039171
Synonyms:
Smiles: CCN(S(=O)(=O)c1ccc(c2c1nsn2)Br)CC

STL039176
Synonyms: N'- {(Z)- [4- hydroxy- 1- (2- methylphenyl)- 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)c1ccccc1C)O

STL039177
Synonyms: 1- {4,6- bis[(4- methoxyphenyl)amino]- 1,3,5- triazin- 2- yl}- 4,5- dimethyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)Nc1nc(Nc2ccc(cc2)OC)nc(n1)n1[nH]c(=O)c(c1C)C

STL039179
Synonyms: 2,4- dibromo- 6- {[(1- propyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: CCCn1c(NCc2cc(Br)cc(c2[O-])Br)[nH+]c2c1cccc2

STL039192
Synonyms: (5Z)- 3- (2- ethoxyphenyl)- 6- hydroxy- 5- [(morpholin- 4- ylamino)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: CCOc1ccccc1N1C(=O)N=C(/C(=C/NN2CCOCC2)/C1=O)O

STL039202
Synonyms: N- cyclohexyl- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 3- carboxamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1cccnc1)C1CCCCC1

STL039209
Synonyms: 2- {[4- hydroxy- 6- (4- methoxyphenyl)pyrimidin- 2- yl]sulfanyl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc(O)cc(n1)c1ccc(cc1)OC

STL039221
Synonyms: N- [(E)- (1- cyclopropyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]tryptophan
Smiles: OC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=O)N=C(N(C1=O)C1CC1)S

STL039228
Synonyms: 7- phenyl- 2- sulfanyl- 5H- pyrano[2,3- d]pyrimidine- 4,5- diol
Smiles: Sc1nc2OC(=CC(c2c(n1)O)O)c1ccccc1

STL039236
Synonyms: ({4- methyl- 5- [4- (propanoylamino)phenyl]- 4H- 1,2,4- triazol- 2- ium- 3- yl}sulfanyl)acetate
Smiles: CCC(=O)Nc1ccc(cc1)c1n[nH+]c(n1C)SCC(=O)[O-]

STL039239
Synonyms: (E)- [4,5- dioxo- 2- phenyl- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](4- methylphenyl)methanolate
Smiles: Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)Cc1ccc[nH+]c1)/[O-]

STL039241
Synonyms: (5- methyl- 7- oxo- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)aceticacid
Smiles: Cc1cc(=O)n2c(n1)[nH]c(n2)CC(=O)O

STL039258
Synonyms: methyl(2Z)- [(2Z)- 2- [(2E)- (furan- 2- ylmethylidene)hydrazinylidene]- 4- hydroxy- 1,3- thiazol- 5(2H)- ylidene]ethanoate
Smiles: COC(=O)/C=C/1\S/C(=N\N=C\c2ccco2)/N=C1O

STL039259
Synonyms: (5Z)- 1- (4- methoxyphenyl)- 5- [(5- nitrothiophen- 2- yl)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C/c2ccc(s2)[N+](=O)[O-])/C1=O)S

STL039265
Synonyms: (E)- (5- methyl- 1- phenyl- 1H- pyrazol- 4- yl){1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxo- 2- phenylpyrrolidin- 3- ylidene}methanolate
Smiles: O=C1C(=O)/C(=C(\c2cnn(c2C)c2ccccc2)/[O-])/C(N1CC[NH+]1CCOCC1)c1ccccc1

STL039278
Synonyms: (4E)- 5- (4- butoxy- 3- ethoxyphenyl)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 1- (2- methoxyethyl)pyrrolidine- 2,3- dione
Smiles: CCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1CCOC

STL039279
Synonyms: 4- hydroxy- 6- oxo- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,2- dihydro- 6H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: O=C(c1c(O)n2CCc3c2c(c1=O)ccc3)NC12CC3CC(C2)CC(C1)C3

STL039280
Synonyms: 1,2- dimethyl- N- [(1Z)- 4- methylphthalazin- 1(2H)- ylidene]- 1H- benzimidazol- 5- amine
Smiles: Cc1n[nH]/c(=N\c2ccc3c(c2)nc(n3C)C)/c2c1cccc2

STL039286
Synonyms: (2Z)- 3- (2,4- dichlorophenyl)- 2- [(4,6- dimethylpyrimidin- 2- yl)imino]- 6- hydroxy- 2,3,4,5- tetrahydropyrimidine- 4- carboxylicacid
Smiles: OC(=O)C1CC(=N/C(=N\c2nc(C)cc(n2)C)/N1c1ccc(cc1Cl)Cl)O

STL039289
Synonyms: N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 4- hydroxy- 1- (2- methylpropyl)- 2- oxo- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: CC(Cn1c2CCCCc2c(c(c1=O)C(=O)/N=c\1/sc2c([nH]1)cccc2)O)C

STL039290
Synonyms: methyl3- cyano- 2- sulfanyl- 6- (thiophen- 2- yl)pyridine- 4- carboxylate
Smiles: COC(=O)c1cc(nc(c1C#N)S)c1cccs1

STL039300
Synonyms: 6- hydroxy- 3- methyl- 7- (4- methylbenzyl)- 8- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1ccc(cc1)Cn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(O)nc(=O)n2C

STL039301
Synonyms: N- [(4E)- 1- benzyl- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]- 4- ethoxyaniline
Smiles: CCOc1ccc(cc1)/N=c\1/nc[nH]c2c1cnn2Cc1ccccc1

STL039311
Synonyms: (E)- (3,4- dimethoxyphenyl)[4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (pyridin- 3- yl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1ccc(cc1OC)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)Cc1ccc[nH+]c1)/[O-]

STL039316
Synonyms: 6- chloro- 3- (diethylamino)- 4- phenylquinolin- 2- ol
Smiles: CCN(c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl)CC

STL039319
Synonyms: (E)- {2- (4- fluorophenyl)- 1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}(3- methoxyphenyl)methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)CCCn1cc[nH+]c1)/[O-]

STL039328
Synonyms: 7- (2- methoxyphenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: COc1ccccc1C1C=C(N=c2n1nc[nH]2)c1ccccc1

STL039331
Synonyms: N'- (benzo[cd]indol- 2- yl)- 2- (4- chlorophenoxy)acetohydrazide
Smiles: O=C(COc1ccc(cc1)Cl)NNC1=Nc2c3c1cccc3ccc2

STL039342
Synonyms: N- [(2E)- 6- methyl- 4,5,6,7- tetrahydro- 1,3- benzothiazol- 2(3H)- ylidene]- 2- (4H- 1,2,4- triazol- 3- ylsulfanyl)acetamide
Smiles: CC1CCc2c(C1)s/c(=N/C(=O)CSc1nnc[nH]1)/[nH]2

STL039370
Synonyms: N- [(2E)- 5- (4- nitrophenyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=c/1\[nH]nc(s1)c1ccc(cc1)[N+](=O)[O-]

STL039374
Synonyms: 3- [(Z)- (5- hydroxy- 2- sulfanyl- 4H- imidazol- 4- ylidene)methyl]- 6- methoxyquinolin- 2(1H)- one
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)/C=C/1\N=C(N=C1O)S

STL039376
Synonyms: 2- [4- (cyclohexylammonio)quinazolin- 2- yl]phenolate
Smiles: [O-]c1ccccc1c1nc2ccccc2c(n1)[NH2+]C1CCCCC1

STL039378
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 2- yl)- 2- (pyridin- 3- yl)pyrrolidin- 3- ylidene](phenyl)methanolate
Smiles: [O-]/C(=C/1\C(c2cccnc2)N(C(=O)C1=O)c1cccc[nH+]1)/c1ccccc1

STL039387
Synonyms: 2- (7- phenyl- 6,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 4- ium- 5- yl)phenolate
Smiles: [O-]c1ccccc1C1=[NH+]c2ncnn2C(C1)c1ccccc1

STL039391
Synonyms: (5E)- 5- [4- (diethylamino)benzylidene]- 2- hydroxy- 1- (4- methoxyphenyl)pyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(cc2)N(CC)CC)/C1=O)O

STL039392
Synonyms: N- [(2Z)- benzo[cd]indol- 2(1H)- ylidene]- 2- methylaniline
Smiles: Cc1ccccc1/N=c/1\[nH]c2c3c1cccc3ccc2

STL039393
Synonyms: (5Z)- 1- cyclohexyl- 5- [(morpholin- 4- ylamino)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\NN1CCOCC1)C1CCCCC1

STL039398
Synonyms: (5E)- 1- cyclohexyl- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NCCCn1ccnc1)C1CCCCC1

STL039403
Synonyms: N- butyl- 5- (4- hydroxyphthalazin- 1- yl)- 2- methylbenzenesulfonamide
Smiles: CCCCNS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)O

STL039421
Synonyms: 1- (4- methoxyphenyl)- 3- [(2Z)- 5- {[(4- methylphenyl)sulfanyl]methyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: COc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)CSc1ccc(cc1)C

STL039425
Synonyms: 6- amino- 4- (4- bromothiophen- 2- yl)- 3- tert- butyl- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1scc(c1)Br)c(n[nH]2)C(C)(C)C

STL039432
Synonyms: 4- fluoro- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- methylbenzamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1ccc(cc1)F)C

STL039438
Synonyms: N- benzyl- 2,4- dihydroxy- 5,6,7,8- tetrahydroquinoline- 3- carboxamide
Smiles: O=C(c1c(O)nc2c(c1O)CCCC2)NCc1ccccc1

STL039442
Synonyms: 2- [(2- methoxyethyl)amino]- 9- methyl- 3- [(Z)- (4- oxo- 2- sulfanyl- 1,3- thiazol- 5(4H)- ylidene)methyl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=NC1=O)S

STL039456
Synonyms: 3- (3,5- dimethylphenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: OC1=NC(=O)N(C(=O)C1)c1cc(C)cc(c1)C

STL039457
Synonyms: 2- methoxy- 6- [(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/c2cccc(c2[O-])OC)sc2c1CC[NH+](C2)C

STL039462
Synonyms: 2- {[2- (dimethylamino)ethyl]sulfanyl}- 5- (propan- 2- yl)pyrimidine- 4,6- diol
Smiles: CN(CCSc1nc(O)c(c(n1)O)C(C)C)C

STL039463
Synonyms: (4E)- 4- [(4- bromophenyl)(hydroxy)methylidene]- 5- (2- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccccc1C1NC(=O)C(=O)/C/1=C(\c1ccc(cc1)Br)/O

STL039465
Synonyms: (4E)- 4- (phenylimino)- 6- [(pyrimidin- 2- ylsulfanyl)methyl]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1nc(CSc2ncccn2)[nH]/c(=N\c2ccccc2)/n1

STL039471
Synonyms: (E)- [1- (1,3- benzothiazol- 3- ium- 2- yl)- 2- (2- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene](4- methylphenyl)methanolate
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccccc2F)N(C(=O)C1=O)c1sc2c([nH+]1)cccc2)/[O-]

STL039498
Synonyms: 2- [(6- methoxy- 4- methylquinazolin- 2- yl)amino]- 6- {[(4- methylphenyl)sulfanyl]methyl}pyrimidin- 4(3H)- one
Smiles: COc1ccc2c(c1)c(C)nc(n2)Nc1nc(CSc2ccc(cc2)C)cc(=O)[nH]1

STL039516
Synonyms: 5- (6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2,6- dihydroxy- 3- (2,4,6- trimethylphenyl)pyrimidin- 4(3H)- one
Smiles: COc1cc2c(cc1OC)CCNC2c1c(O)nc(n(c1=O)c1c(C)cc(cc1C)C)O

STL039517
Synonyms: 6- ({4- [6- bromo- 4- (2- chlorophenyl)quinazolin- 2- yl]piperazin- 4- ium- 1- yl}carbonyl)cyclohex- 3- ene- 1- carboxylate
Smiles: [O-]C(=O)C1CC=CCC1C(=O)N1CC[NH+](CC1)c1nc2ccc(cc2c(n1)c1ccccc1Cl)Br

STL039521
Synonyms: (2E)- 5,5- bis(hydroxymethyl)- 2- [(4- methylphenyl)imino]- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: OCC1(CO)S/C(=N/c2ccc(cc2)C)/N=C1O

STL039525
Synonyms: N- [(2E)- 5- {[(2- fluorobenzyl)sulfanyl]methyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- methylpropanamide
Smiles: O=C(C(C)C)/N=c/1\[nH]nc(s1)CSCc1ccccc1F

STL039527
Synonyms: N- [5- (4- chlorophenyl)- 7- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]furan- 2- carboxamide
Smiles: Clc1ccc(cc1)C1=CC(c2ccccc2)n2c(=N1)[nH]c(n2)NC(=O)c1ccco1

STL039533
Synonyms: N- (2- ethoxyphenyl)- 6- (4- fluorophenyl)- 4- methyl- 2- sulfanyl- 1,6- dihydropyrimidine- 5- carboxamide
Smiles: CCOc1ccccc1NC(=O)C1=C(C)N=C(NC1c1ccc(cc1)F)S

STL039535
Synonyms: 7- (2- chloro- 6- fluorophenyl)- 5- (4- methylphenyl)- 3,7- dihydrotetrazolo[1,5- a]pyrimidine
Smiles: Cc1ccc(cc1)C1=CC(n2c(=N1)[nH]nn2)c1c(F)cccc1Cl

STL039542
Synonyms: N- [(2E)- 4,6- dimethylquinazolin- 2(1H)- ylidene]- 5- [2- (morpholin- 4- yl)ethyl]- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: Cc1ccc2c(c1)c(C)n/c(=N/C1=NCN(CN1)CCN1CCOCC1)/[nH]2

STL039546
Synonyms: N- cyclohexyl- N- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]cyclohexanaminium
Smiles: OC(CN1C(=NC(C1=O)(C)C)O)C[NH+](C1CCCCC1)C1CCCCC1

STL039549
Synonyms: 4- [3- (6- chloro- 2- hydroxy- 4- phenylquinolin- 3- yl)- 5- (pyridin- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccccn1)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STL039552
Synonyms: (5Z)- 1- (4- chlorophenyl)- 5- (3,4- dihydroxybenzylidene)- 2- hydroxypyrimidine- 4,6(1H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C/c2ccc(c(c2)O)O)/C1=O)O

STL039558
Synonyms: 5- methyl- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(3H)- one
Smiles: Cc1cc(=O)n2c(n1)[nH]c(n2)c1ccccc1

STL039567
Synonyms: (5Z)- 3- (4- fluorobenzyl)- 6- hydroxy- 5- [4- (pyrrolidin- 1- yl)benzylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: Fc1ccc(cc1)CN1C(=O)N=C(/C(=C/c2ccc(cc2)N2CCCC2)/C1=O)O

STL039572
Synonyms: N'- [(E)- (1- methyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]benzohydrazide
Smiles: O=C(c1ccccc1)NN/C=C/1\C(=O)N=C(N(C1=O)C)S

STL039576
Synonyms: (5E)- 5- [(azepan- 1- ylamino)methylidene]- 3- (2- ethoxyphenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCOc1ccccc1N1C(=O)N=C(/C(=C\NN2CCCCCC2)/C1=O)O

STL039577
Synonyms: (E)- {1- [2- (dimethylammonio)ethyl]- 2- [4- (methoxycarbonyl)phenyl]- 4,5- dioxopyrrolidin- 3- ylidene}(2,8- dimethylimidazo[1,2- a]pyridin- 3- yl)methanolate
Smiles: COC(=O)c1ccc(cc1)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2C)/[O-]

STL039580
Synonyms: 5- (phenoxymethyl)- 4- ({(E)- [2- (trifluoromethyl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1/N=C/c1ccccc1C(F)(F)F)COc1ccccc1

STL039581
Synonyms: (E)- (3- methoxyphenyl)[2- (3- nitrophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])Cc1ccc[nH+]c1)/[O-]

STL039587
Synonyms: 4- {(3E)- 2- (4- chlorophenyl)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 4,5- dioxopyrrolidin- 1- yl}butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)Cl)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STL039590
Synonyms: (E)- [4,5- dioxo- 2- phenyl- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](4- methoxy- 2- methylphenyl)methanolate
Smiles: COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)Cc1ccc[nH+]c1)/[O-]

STL039591
Synonyms: (5Z)- 1- methyl- 5- (1H- pyrrol- 2- ylmethylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN1C(=NC(=O)/C(=C/c2[nH]ccc2)/C1=O)S

STL039602
Synonyms: (E)- (4- chlorophenyl){1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- (pyridin- 3- yl)pyrrolidin- 3- ylidene}methanolate
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CCCn1cc[nH+]c1)/[O-]

STL039635
Synonyms: 5- {[(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}- 4H- pyrazol- 3- ol
Smiles: OC1=NN=C(C1)CSc1nnnn1c1ccccc1

STL039643
Synonyms: (5E)- 5- [(2,5- dimethyl- 1H- pyrrol- 3- yl)methylidene]- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C/c2cc([nH]c2C)C)/C(=N1)O

STL039653
Synonyms: 6- methyl- 5- {(E)- [(4- methylpiperazin- 1- yl)imino]methyl}pyrimidine- 2,4- diol
Smiles: CN1CCN(CC1)/N=C/c1c(C)nc(nc1O)O

STL039657
Synonyms: 8,8- dimethyl- 2- sulfanyl- 8,9- dihydro- 6H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- ol
Smiles: Sc1nc2nc3CC(C)(C)OCc3cc2c(n1)O

STL039661
Synonyms: N'- [(E)- (1- cyclopropyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]heptanehydrazide
Smiles: CCCCCCC(=O)NN/C=C/1\C(=O)N=C(N(C1=O)C1CC1)S

STL039665
Synonyms: (6Z)- 6- [(4- methoxyphenyl)imino]- 4- [(4- phenylpiperazin- 1- yl)methyl]- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: COc1ccc(cc1)/N=c/1\nc(CN2CCN(CC2)c2ccccc2)nc([nH]1)N

STL039668
Synonyms: [(5Z)- 4- oxo- 5- (pyridinium- 4- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]acetate
Smiles: [O-]C(=O)CN1C(=S)S/C(=C\c2cc[nH+]cc2)/C1=O

STL039672
Synonyms: N'- [(E)- (2,4- dihydroxy- 6- methylpyrimidin- 5- yl)methylidene]- 3- (4- propoxyphenyl)propanehydrazide
Smiles: CCCOc1ccc(cc1)CCC(=O)N/N=C/c1c(C)nc(nc1O)O

STL039673
Synonyms: 5- (2,4- dimethylphenyl)- 2- sulfanylthieno[2,3- d]pyrimidin- 4- ol
Smiles: Cc1ccc(c(c1)C)c1csc2c1c(O)nc(n2)S

STL039680
Synonyms: (E)- [2- (4- ethoxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](5- methylfuran- 2- yl)methanolate
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(o2)C)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL039692
Synonyms: 3- hydroxy- 5,5- dimethyl- 2- [(1E)- N- (4- methylphenyl)ethanimidoyl]cyclohex- 2- en- 1- one
Smiles: Cc1ccc(cc1)/N=C(/C1=C(O)CC(CC1=O)(C)C)\C

STL039703
Synonyms: 1- (1,3- benzothiazol- 2- yl)- 4- [(E)- 2- (benzylamino)ethenyl]- 3- propyl- 1H- pyrazol- 5- ol
Smiles: CCCc1nn(c(c1/C=C/NCc1ccccc1)O)c1nc2c(s1)cccc2

STL039717
Synonyms: ethyl(4- sulfanylphthalazin- 1- yl)acetate
Smiles: CCOC(=O)Cc1nnc(c2c1cccc2)S

STL039726
Synonyms: N- (2- {2- [(E)- (1- benzyl- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)methyl]- 1H- indol- 3- yl}ethyl)acetamide
Smiles: CC(=O)NCCc1c(/C=C/2\C(=NC(=O)N(C2=O)Cc2ccccc2)O)[nH]c2c1cccc2

STL039728
Synonyms: 7- (3- bromobenzyl)- 8- {[2- (diethylamino)ethyl]amino}- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCN(CCNc1nc2c(n1Cc1cccc(c1)Br)c(O)nc(=O)n2C)CC

STL039731
Synonyms: (E)- {4,5- dioxo- 2- [3- (prop- 2- en- 1- yloxy)phenyl]- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene}(4- fluorophenyl)methanolate
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL039737
Synonyms: (E)- [2- (4- fluorophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene][4- (prop- 2- en- 1- yloxy)phenyl]methanolate
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)Cc1ccc[nH+]c1)/[O-]

STL039758
Synonyms: 4- hydroxy- 2- oxo- 1- pentyl- N- [(2E)- 5- propyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCCCn1c(=O)c(C(=O)/N=c/2\[nH]nc(s2)CCC)c(c2c1cccc2)O

STL039759
Synonyms: (5Z)- 1- (3,4- dimethylphenyl)- 2- hydroxy- 5- [(1- methyl- 1H- indol- 3- yl)methylidene]pyrimidine- 4,6(1H,5H)- dione
Smiles: OC1=NC(=O)/C(=C/c2cn(c3c2cccc3)C)/C(=O)N1c1ccc(c(c1)C)C

STL039784
Synonyms: 4- {(3E)- 2- (2,4- dimethoxyphenyl)- 3- [hydroxy(4- methylphenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}butanoicacid
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1CCCC(=O)O

STL039786
Synonyms: 5- (furan- 2- yl)- 4- {[(E)- phenylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1/N=C/c1ccccc1)c1ccco1

STL039787
Synonyms: N- [1- (4- fluorophenyl)- 4- hydroxy- 2,6- dioxo- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]benzenesulfonamide
Smiles: Fc1ccc(cc1)n1c(=O)nc(c2c1NC(=O)C2(NS(=O)(=O)c1ccccc1)C(F)(F)F)O

STL039803
Synonyms: (5Z)- 5- (3,4- dimethoxybenzylidene)- 1- (2- fluorophenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccc(cc1OC)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1F)S

STL039811
Synonyms: 5- phenyl- 4- {[(E)- pyridin- 3- ylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1/N=C/c1cccnc1)c1ccccc1

STL039819
Synonyms: {(4Z)- 7,7- dimethyl- 4- [(2- methylphenyl)imino]- 2- sulfanyl- 8- oxa- 1,3- diazaspiro[4.5]dec- 2- en- 1- yl}acetonitrile
Smiles: N#CCN1C(=N/C(=N\c2ccccc2C)/C21CCOC(C2)(C)C)S

STL039826
Synonyms: 3,4,5- triethoxy- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- methylbenzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)N(Cc1cc2cc(OC)ccc2[nH]c1=O)C

STL039827
Synonyms: 1- (2- methoxyphenyl)- 3- [(2E)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: COc1ccccc1NC(=O)/N=c/1\[nH]nc(s1)CC(C)C

STL039850
Synonyms: 3'- (3,5- dimethylphenyl)- 2- hydroxy- 4'H- spiro[indole- 3,2'- [1,3]thiazolidin]- 4'- one
Smiles: Cc1cc(C)cc(c1)N1C(=O)CSC21C(=Nc1c2cccc1)O

STL039852
Synonyms: 4- {[(E)- (5- bromo- 2- methoxyphenyl)methylidene]amino}- 5- (pyridin- 4- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1ccncc1)Br

STL039868
Synonyms: (4- bromophenyl)[5- (2- hydroxyphenyl)- 1H- pyrazol- 4- yl]methanone
Smiles: Brc1ccc(cc1)C(=O)c1cn[nH]c1c1ccccc1O

STL039874
Synonyms: 2- [(E)- 2- (2- chlorophenyl)ethenyl]quinazolin- 4- ol
Smiles: Clc1ccccc1/C=C/c1nc(O)c2c(n1)cccc2

STL039877
Synonyms: 5- (4- methoxyphenyl)thieno[2,3- d]pyrimidin- 4- ol
Smiles: COc1ccc(cc1)c1csc2c1c(O)ncn2

STL039885
Synonyms: [5- (5- chloro- 2- hydroxyphenyl)- 1H- pyrazol- 4- yl](4- methylphenyl)methanone
Smiles: Cc1ccc(cc1)C(=O)c1cn[nH]c1c1cc(Cl)ccc1O

STL039887
Synonyms: 2,4- dimethyl- N- [(4Z)- 1- phenyl- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]aniline
Smiles: Cc1ccc(c(c1)C)/N=c/1\nc[nH]c2c1cnn2c1ccccc1

STL039908
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- [3- (prop- 2- en- 1- yloxy)phenyl]pyrrolidin- 3- ylidene}(4- methylphenyl)methanolate
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL039911
Synonyms: N- [(1Z)- 4- methylphthalazin- 1(2H)- ylidene]- 1,3- benzodioxol- 5- amine
Smiles: Cc1n[nH]/c(=N\c2ccc3c(c2)OCO3)/c2c1cccc2

STL039912
Synonyms: 4- chloro- 2- {1- [(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)ammonio]ethyl}phenolate
Smiles: Clc1ccc(c(c1)C([NH2+]c1c(C)n(n(c1=O)c1ccccc1)C)C)[O-]

STL039918
Synonyms: (5Z)- 2- hydroxy- 5- (1H- indol- 3- ylmethylidene)- 1- (2- methoxyphenyl)pyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccccc1N1C(=NC(=O)/C(=C/c2c[nH]c3c2cccc3)/C1=O)O

STL039922
Synonyms: 5- ethyl- 2- (3- methylbutyl)- 5- propyl- 2,5- dihydro- 1H- 1,2,4- triazole- 3- thiol
Smiles: CCCC1(CC)N=C(N(N1)CCC(C)C)S

STL039929
Synonyms: {(3E)- 2- (4- chlorophenyl)- 3- [hydroxy(4- methylphenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}aceticacid
Smiles: OC(=O)CN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)Cl

STL039947
Synonyms: (8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl3,4- dimethoxybenzoate
Smiles: COc1cc(ccc1OC)C(=O)OCc1cc2cccc(c2[nH]c1=O)C

STL039955
Synonyms: 8- [(2- chloro- 6- fluorobenzyl)sulfanyl]- 7- dodecyl- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCCCCCCCCn1c(SCc2c(F)cccc2Cl)nc2c1c(O)nc(=O)n2C

STL039960
Synonyms: methyl(2Z)- [(2Z)- 2- {[(3- chlorophenyl)carbonyl]imino}- 4- hydroxy- 1,3- thiazol- 5(2H)- ylidene]ethanoate
Smiles: COC(=O)/C=C/1\S/C(=N\C(=O)c2cccc(c2)Cl)/N=C1O

STL039969
Synonyms: (5Z)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]- 1- (2- methylphenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\C=C\c1ccco1)c1ccccc1C

STL039973
Synonyms: 2- ethyl4- methyl5- (4,6- dioxo- 2- phenyl- 3- {4- [(phenylsulfonyl)oxy]phenyl}hexahydro- 5H- pyrrolo[3,4- d][1,2]oxazol- 5- yl)- 3- methylthiophene- 2,4- dicarboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C(=O)OC)N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)OS(=O)(=O)c1ccccc1)c1ccccc1

STL039979
Synonyms: 3- hydroxy- N- (6- methylpyridin- 2- yl)- 1- oxo- 6,7- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 2- carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1c(=O)c2cccc3c2n(c1O)CCC3

STL039984
Synonyms: 3- (1H- 3,1- benzimidazol- 3- ium- 2- yl)benzoate
Smiles: [O-]C(=O)c1cccc(c1)c1[nH]c2c([nH+]1)cccc2

STL039989
Synonyms: (E)- 1- benzofuran- 2- yl{1- [2- (dimethylammonio)ethyl]- 2- (4- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: C[NH+](CCN1C(c2ccc(cc2)F)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)C

STL039992
Synonyms: 3- methoxy- N- [(2Z)- 6- methyl- 4- phenylquinazolin- 2(3H)- ylidene]aniline
Smiles: COc1cccc(c1)/N=c/1\nc2ccc(cc2c([nH]1)c1ccccc1)C

STL039997
Synonyms: N- [(E)- amino{[(2E)- 4,6- dimethylquinazolin- 2(3H)- ylidene]amino}methylidene]- 2- (methylamino)benzamide
Smiles: CNc1ccccc1C(=O)/N=C(/N=c\1/nc2ccc(cc2c([nH]1)C)C)\N

STL039999
Synonyms: 1- (2- methylphenyl)- N- [(1E)- 4- methylphthalazin- 1(2H)- ylidene]- 1H- benzimidazol- 5- amine
Smiles: Cc1n[nH]/c(=N/c2ccc3c(c2)ncn3c2ccccc2C)/c2c1cccc2

STL040017
Synonyms: 1- [7- (2- ethoxyethyl)- 6- hydroxy- 3- methyl- 2- oxo- 3,7- dihydro- 2H- purin- 8- yl]piperidine- 4- carboxamide
Smiles: CCOCCn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)C(=O)N

STL040035
Synonyms: methyl[(2Z)- 2- {[N- (3- methylphenyl)carbamimidoyl]imino}- 6- oxo- 1,2,3,6- tetrahydropyrimidin- 4- yl]acetate
Smiles: COC(=O)Cc1cc(=O)[nH]/c(=N\C(=N)Nc2cccc(c2)C)/[nH]1

STL040052
Synonyms: 4- (4- ethoxyphenyl)- 7- hydroxy- 1- (propan- 2- yl)- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: CCOc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C(C)C)O

STL040053
Synonyms: N- [(2Z)- 6- methyl- 4,5,6,7- tetrahydro- 1,3- benzothiazol- 2(3H)- ylidene]- 2- (morpholin- 4- yl)acetamide
Smiles: CC1CCc2c(C1)s/c(=N\C(=O)CN1CCOCC1)/[nH]2

STL040058
Synonyms: 4- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]morpholin- 4- ium
Smiles: OC(CN1C(=NC(C1=O)(C)C)O)C[NH+]1CCOCC1

STL040065
Synonyms: N,N'- 3,7- dihydrobenzo[1,2- d:4,5- d']bis[1,3]thiazole- 2,6- diylidenediacetamide
Smiles: CC(=O)/N=c\1/sc2c([nH]1)cc1c(c2)[nH]/c(=N\C(=O)C)/s1

STL040073
Synonyms: 2- methoxy- 4- {[2- (morpholin- 4- ium- 4- yl)ethoxy]carbonyl}phenolate
Smiles: COc1cc(ccc1[O-])C(=O)OCC[NH+]1CCOCC1

STL040091
Synonyms: 2- [(2E)- 1,3- benzoxazol- 2(3H)- ylideneamino]- 1- methylquinazolin- 4(1H)- one
Smiles: Cn1c(/N=c\2/oc3c([nH]2)cccc3)nc(=O)c2c1cccc2

STL040093
Synonyms: 3,5- dichloro- N- [(4E)- 2- (pyridin- 4- yl)quinazolin- 4(3H)- ylidene]aniline
Smiles: Clc1cc(Cl)cc(c1)/N=c\1/[nH]c(nc2c1cccc2)c1ccncc1

STL040094
Synonyms: (5E)- 2- hydroxy- 5- {[(2- phenylethyl)amino]methylidene}pyrimidine- 4,6(1H,5H)- dione
Smiles: OC1=NC(=O)/C(=C/NCCc2ccccc2)/C(=O)N1

STL040101
Synonyms: N- [4- hydroxy- 2,6- dioxo- 1- phenyl- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]- 2,2- dimethylpropanamide
Smiles: O=C(C(C)(C)C)NC1(C(=O)Nc2c1c(O)nc(=O)n2c1ccccc1)C(F)(F)F

STL040106
Synonyms: 4- {(E)- [(4- methoxy- 2- nitrophenyl)imino]methyl}- 3- methyl- 1- phenyl- 1H- pyrazol- 5- ol
Smiles: COc1ccc(c(c1)[N+](=O)[O-])/N=C/c1c(C)nn(c1O)c1ccccc1

STL040113
Synonyms: 4- (2,4- dichlorophenyl)- 7- hydroxy- 1- (pentan- 3- yl)- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: CCC(n1[nH]c(=O)c2c1N=C(O)CSC2c1ccc(cc1Cl)Cl)CC

STL040122
Synonyms: N'- [(3Z)- 5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- 3- (3- hydroxy- 5- methyl- 1H- pyrazol- 4- yl)propanehydrazide
Smiles: O=C(CCc1c(C)[nH]nc1O)N/N=C/1\C(=O)Nc2c1cc(Br)cc2

STL040123
Synonyms: N- {5- [(2,4- dichlorobenzyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}acetamide
Smiles: CC(=O)Nc1nnc([nH]1)SCc1ccc(cc1Cl)Cl

STL040125
Synonyms: N- [(2Z)- 7,7- dimethyl- 5- oxo- 5,6,7,8- tetrahydroquinazolin- 2(1H)- ylidene]benzamide
Smiles: O=C(c1ccccc1)/N=c/1\ncc2c([nH]1)CC(CC2=O)(C)C

STL040126
Synonyms: 5- [(5- methyl- 7- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)amino]- 5- oxopentanoicacid
Smiles: O=C(Nc1[nH]c2=NC(=CC(n2n1)c1ccccc1)C)CCCC(=O)O

STL040136
Synonyms: 2- (1,3- benzothiazol- 3- ium- 2- ylamino)- 6- phenylpyrimidine- 4- carboxylate
Smiles: [O-]C(=O)c1nc(Nc2sc3c([nH+]2)cccc3)nc(c1)c1ccccc1

STL040139
Synonyms: 3- {(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 4,5- dioxo- 2- phenylpyrrolidin- 1- yl}propanoicacid
Smiles: OC(=O)CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1

STL040143
Synonyms: 3- [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (4- methoxyphenyl)- 4,5- dioxopyrrolidin- 1- yl]propanoicacid
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCC(=O)O

STL040144
Synonyms: N- [7- (4- chlorophenyl)- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]furan- 2- carboxamide
Smiles: Clc1ccc(cc1)C1C=C(C)N=c2n1nc([nH]2)NC(=O)c1ccco1

STL040149
Synonyms: 3,4- dimethyl- N- [(7Z)- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(4H)- ylidene]aniline
Smiles: Cc1c/c(=N/c2ccc(c(c2)C)C)/n2c([nH]1)ncn2

STL040172
Synonyms: ethyl4- {[(E)- (6- hydroxy- 4- oxo- 2- sulfanylpyrimidin- 5(4H)- ylidene)methyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N/C=C/1\C(=NC(=NC1=O)S)O

STL040181
Synonyms: 4- tert- butyl- N- methyl- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1ccc(cc1)C(C)(C)C)C

STL040183
Synonyms: 4- [(Z)- (3- oxo[1,3]thiazolo[3,2- a]benzimidazol- 9- ium- 2(3H)- ylidene)methyl]benzoate
Smiles: [O-]C(=O)c1ccc(cc1)/C=c/1\sc2n(c1=O)c1c([nH+]2)cccc1

STL040186
Synonyms: 5- [(4Z)- 4- (1,3- benzodioxol- 5- ylimino)- 3,4- dihydrophthalazin- 1- yl]- 2- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1S(=O)(=O)N)c1n[nH]/c(=N\c2ccc3c(c2)OCO3)/c2c1cccc2

STL040192
Synonyms: 6- {[4- (6- methyl- 4- phenylquinazolin- 2- yl)piperazin- 4- ium- 1- yl]carbonyl}cyclohex- 3- ene- 1- carboxylate
Smiles: [O-]C(=O)C1CC=CCC1C(=O)N1CC[NH+](CC1)c1nc2ccc(cc2c(n1)c1ccccc1)C

STL040201
Synonyms: 4,6,6- trimethyl- 3- (2- phenylethyl)- 2- sulfanyl- 3,4,5,6- tetrahydropyrimidin- 4- ol
Smiles: SC1=NC(C)(C)CC(N1CCc1ccccc1)(C)O

STL040204
Synonyms: (E)- [2- (4- methoxyphenyl)- 4,5- dioxo- 1- (pyridinium- 2- yl)pyrrolidin- 3- ylidene](4- propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)OC)c1cccc[nH+]1)/[O-]

STL040213
Synonyms: 6- ethyl- 4- oxo- 3- (2- phenyl- 1,3- thiazol- 3- ium- 4- yl)- 4H- chromen- 7- olate
Smiles: CCc1cc2c(cc1[O-])occ(c2=O)c1csc([nH+]1)c1ccccc1

STL040224
Synonyms: N- [(2Z)- 5- (3- ethoxyphenyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]thiophene- 2- carboxamide
Smiles: CCOc1cccc(c1)c1n[nH]/c(=N/C(=O)c2cccs2)/s1

STL040231
Synonyms: (2E)- 2- [(2- chlorophenyl)imino]- 5,5- dimethyl- 2,3,5,6- tetrahydro- 1,3- benzothiazol- 7(4H)- one
Smiles: O=C1CC(C)(C)Cc2c1s/c(=N/c1ccccc1Cl)/[nH]2

STL040233
Synonyms: (6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methylthiophene- 2- carboxylate
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)COC(=O)c1cccs1

STL040241
Synonyms: (E)- [2- (2- chlorophenyl)- 4,5- dioxo- 1- (pyrimidin- 1- ium- 2- yl)pyrrolidin- 3- ylidene](phenyl)methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1ccccc1Cl)c1nccc[nH+]1)/c1ccccc1

STL040245
Synonyms: 4- chloro- 2- {[(1- methyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: Clc1ccc(c(c1)CNc1[nH+]c2c(n1C)cccc2)[O-]

STL040254
Synonyms: methyl(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- hydroxy- 4,5- dioxo- 1- phenylprolinate
Smiles: COC(=O)C1(O)N(c2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)Cl)/O

STL040271
Synonyms: (5E)- 1- (4- methoxyphenyl)- 5- ({[2- (morpholin- 4- yl)ethyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C\NCCN2CCOCC2)/C1=O)S

STL040285
Synonyms: (5E)- 3- (4- fluorophenyl)- 6- hydroxy- 5- ({1- [2- (2- methylphenoxy)ethyl]- 1H- pyrrol- 2- yl}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cccn2CCOc2ccccc2C)/C1=O)O

STL040287
Synonyms: (E)- {2- (4- tert- butylphenyl)- 1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}(5- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methanolate
Smiles: O=C1C(=O)/C(=C(\c2cnn(c2C)c2ccccc2)/[O-])/C(N1CC[NH+]1CCOCC1)c1ccc(cc1)C(C)(C)C

STL040295
Synonyms: 3- {[(3,4- dimethylphenyl)amino]methyl}quinolin- 2(1H)- one
Smiles: Cc1ccc(cc1C)NCc1cc2ccccc2[nH]c1=O

STL040297
Synonyms: N- [(4E)- 1- benzyl- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]- 4- chloroaniline
Smiles: Clc1ccc(cc1)/N=c\1/nc[nH]c2c1cnn2Cc1ccccc1

STL040298
Synonyms: (2Z)- 4- hydroxy- 2- [2- (phenylcarbonyl)hydrazinylidene]- 5,6- dihydro- 2H- 1,3- thiazine- 6- carboxylicacid
Smiles: O=C(c1ccccc1)N/N=C/1\SC(CC(=N1)O)C(=O)O

STL040304
Synonyms: 1- (4- ethoxyphenyl)- 4,4,6- trimethyl- 1,4- dihydropyrimidine- 2- thiol
Smiles: CCOc1ccc(cc1)N1C(=CC(N=C1S)(C)C)C

STL040316
Synonyms: 1- (morpholin- 4- ylmethyl)- 3- sulfanylquinoxaline- 2(1H)- thione
Smiles: Sc1nc2ccccc2n(c1=S)CN1CCOCC1

STL040317
Synonyms: 4- [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (2- fluorophenyl)- 4,5- dioxopyrrolidin- 1- yl]butanoicacid
Smiles: OC(=O)CCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1F

STL040319
Synonyms: (8E)- 8- {[4- (methoxycarbonyl)phenyl]imino}- 5- oxo- 6- (4- phenylpiperazin- 4- ium- 1- yl)- 5,8- dihydronaphthalen- 1- olate
Smiles: COC(=O)c1ccc(cc1)/N=C/1\C=C(N2CC[NH+](CC2)c2ccccc2)C(=O)c2c1c([O-])ccc2

STL040339
Synonyms: 5- benzyl- 6- hydroxy- 1- (2- methoxyphenyl)- 2- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}pyrimidin- 4(1H)- one
Smiles: COc1ccccc1n1c(SCC(=O)N2CCCCC2)nc(=O)c(c1O)Cc1ccccc1

STL040352
Synonyms: 3- [(1Z)- 2- hydroxy- 3,3- dimethylbut- 1- en- 1- yl]- 6- nitroquinoxalin- 2- ol
Smiles: O/C(=C\c1nc2cc(ccc2nc1O)[N+](=O)[O-])/C(C)(C)C

STL040354
Synonyms: (2E,5Z)- 2- [(2- chlorophenyl)imino]- 5- (4- hydroxy- 3- methoxybenzylidene)- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: COc1cc(ccc1O)/C=C/1\S/C(=N/c2ccccc2Cl)/N=C1O

STL040373
Synonyms: 4- {[(E)- (2,3- dichlorophenyl)methylidene]amino}- 5- (phenoxymethyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1c(cccc1Cl)/C=N/n1c(COc2ccccc2)n[nH]c1=S

STL040379
Synonyms: 4- {[(E)- (4- methylphenyl)methylidene]amino}- 5- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccnc1

STL040383
Synonyms: 8- hydroxy- 7- [(6- hydroxy- 8- oxo- 3,4- dihydro- 2H,8H- pyrimido[2,1- b][1,3]thiazin- 7- yl)(pyridin- 4- yl)methyl]- 3,4- dihydro- 2H,6H- pyrimido[2,1- b][1,3]thiazin- 6- one
Smiles: O=c1nc2SCCCn2c(c1C(c1c(O)nc2n(c1=O)CCCS2)c1ccncc1)O

STL040384
Synonyms: 2- {3- [(E)- 2- (2,4- dihydroxyphenyl)ethenyl]- 1- phenyl- 1H- 1,2,4- triazol- 4- ium- 5- yl}phenolate
Smiles: Oc1ccc(c(c1)O)/C=C/c1nn(c([nH+]1)c1ccccc1[O-])c1ccccc1

STL040385
Synonyms: 3- {[(2,5- dimethylphenyl)amino]methyl}- 8- methylquinolin- 2(1H)- one
Smiles: Cc1ccc(c(c1)NCc1cc2cccc(c2[nH]c1=O)C)C

STL040394
Synonyms: N- (4- chlorophenyl)- N- [N'- (4,6- dimethylpyrimidin- 2- yl)carbamimidoyl]- 4- methylbenzenesulfonamide
Smiles: Clc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)/C(=N/c1nc(C)cc(n1)C)/N

STL040395
Synonyms: (5Z)- 6- hydroxy- 5- [(piperidin- 1- ylamino)methylidene]- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C/NN2CCCCC2)/C1=O)O

STL040417
Synonyms: N- [(2E)- 5- {[(4- methoxy- 6- methylpyrimidin- 2- yl)carbamoyl]amino}- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]benzenesulfonamide
Smiles: COc1nc(NC(=O)Nc2s/c(=N/S(=O)(=O)c3ccccc3)/[nH]c2C)nc(c1)C

STL040421
Synonyms: 4- [5- (4- chlorophenyl)- 3,7- dihydrotetrazolo[1,5- a]pyrimidin- 7- yl]- N,N- dimethylaniline
Smiles: Clc1ccc(cc1)C1=CC(c2ccc(cc2)N(C)C)n2c(=N1)[nH]nn2

STL040431
Synonyms: {(3E)- 2- (2- fluorophenyl)- 3- [hydroxy(phenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}aceticacid
Smiles: OC(=O)CN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1F

STL040434
Synonyms: 9- methyl- 2- (4- methylpiperazin- 1- yl)- 3- [(Z)- (4- oxo- 2- sulfanyl- 1,3- thiazol- 5(4H)- ylidene)methyl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=NC1=O)S

STL040437
Synonyms: 1,3- dimethyl- 7- (3- phenylpropyl)- 8- thioxo- 3,7,8,9- tetrahydro- 1H- purine- 2,6- dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n(CCCc1ccccc1)c(=S)[nH]2

STL040441
Synonyms: ethyl(6- hydroxy- 4,4,6- trimethyl- 2- sulfanyl- 5,6- dihydropyrimidin- 1(4H)- yl)acetate
Smiles: CCOC(=O)CN1C(=NC(CC1(C)O)(C)C)S

STL040461
Synonyms: N- (3- chloro- 4- methylphenyl)- 6- hydroxy- 2- (morpholin- 4- yl)- 4,5- dihydropyrimidine- 4- carboxamide
Smiles: O=C(C1CC(=NC(=N1)N1CCOCC1)O)Nc1ccc(c(c1)Cl)C

STL040467
Synonyms: N- [(2E)- 5- (3,4- dimethoxyphenyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- (4- methoxyphenoxy)acetamide
Smiles: COc1ccc(cc1)OCC(=O)/N=c/1\[nH]nc(s1)c1ccc(c(c1)OC)OC

STL040474
Synonyms: 4- [2- ([1]benzofuro[3,2- d]pyrimidin- 4- ylamino)ethyl]benzenesulfonamide
Smiles: NS(=O)(=O)c1ccc(cc1)CCNc1ncnc2c1oc1c2cccc1

STL040501
Synonyms: N- (5- oxo- 7- phenyl- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)- 3- phenylpropanamide
Smiles: O=C(Nc1[nH]c2=NC(=O)CC(n2n1)c1ccccc1)CCc1ccccc1

STL040503
Synonyms: N- [(3Z)- 1- butyl- 6- methoxy- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 2- phenoxyacetamide
Smiles: CCCCn1[nH]/c(=N\C(=O)COc2ccccc2)/c2c1nc1ccc(cc1c2)OC

STL040505
Synonyms: (5E)- 5- {1- [(3- fluorophenyl)amino]propylidene}- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: CC/C(=C\1/C(=NC(=NC1=O)O)O)/Nc1cccc(c1)F

STL040515
Synonyms: 3- [5- (4- fluorophenyl)- 1,2,4- oxadiazol- 3- yl]- 6- methoxyquinolin- 2(1H)- one
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)c1noc(n1)c1ccc(cc1)F

STL040516
Synonyms: 4- [(4- chlorophenyl)amino]- 4- oxo- 3- (pyrrolidinium- 1- yl)butanoate
Smiles: O=C(C([NH+]1CCCC1)CC(=O)[O-])Nc1ccc(cc1)Cl

STL040517
Synonyms: 5- ethyl- 2- [(7- methoxy- 4- methylquinazolin- 2- yl)amino]- 6- methylpyrimidin- 4- ol
Smiles: COc1ccc2c(c1)nc(nc2C)Nc1nc(C)c(c(n1)O)CC

STL040519
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- naphthalen- 1- ylmethylidene]- 5- (4- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)N/N=C/c1cccc2c1cccc2

STL040526
Synonyms: N- [(2- chlorobenzyl)carbamoyl]valine
Smiles: O=C(NC(C(=O)O)C(C)C)NCc1ccccc1Cl

STL040533
Synonyms: N- [7- (4- chlorophenyl)- 5- oxo- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 2- (naphthalen- 2- yloxy)acetamide
Smiles: O=C(Nc1nn2c(=NC(=O)CC2c2ccc(cc2)Cl)[nH]1)COc1ccc2c(c1)cccc2

STL040548
Synonyms: 7- [2- (1,3- benzoxazol- 2- ylsulfanyl)ethyl]- 6- hydroxy- 3- methyl- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cn1c(=O)nc(c2c1nc(n2CCSc1nc2c(o1)cccc2)N1CCCC1)O

STL040564
Synonyms: methyl[(5E)- 5- {[(4- nitrophenyl)carbonyl]imino}- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]acetate
Smiles: COC(=O)Cc1n[nH]/c(=N\C(=O)c2ccc(cc2)[N+](=O)[O-])/s1

STL040565
Synonyms: N- [(4E)- 2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4(3H)- ylidene]- 2- methoxy- 5- methylaniline
Smiles: CCc1[nH]/c(=N/c2cc(C)ccc2OC)/c2c(n1)c1ccccc1o2

STL040581
Synonyms: 3- ({(1Z)- 1- [1- (4- chlorophenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}amino)benzoicacid
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C(/Nc2cccc(c2)C(=O)O)\C)/C1=O)O

STL040589
Synonyms: (4E)- 5- [3- ethoxy- 4- (prop- 2- en- 1- yloxy)phenyl]- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 1- (2- methoxyethyl)pyrrolidine- 2,3- dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(c(c1)OCC)OCC=C

STL040595
Synonyms: 3- (4- phenoxyphenyl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- imine5,5- dioxide
Smiles: N=C1SC2C(N1c1ccc(cc1)Oc1ccccc1)CS(=O)(=O)C2

STL040610
Synonyms: (2E)- 3- (4- carboxyphenyl)- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: [O-]C(=O)/C(=C\c1ccc(cc1)C(=O)O)/Sc1[nH]nc([nH+]1)C

STL040630
Synonyms: 2- hydroxy- 5- [(2Z)- 2- (2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene)hydrazinyl]benzoicacid
Smiles: OC1=NC(=O)/C(=N\Nc2ccc(c(c2)C(=O)O)O)/C(=O)N1

STL040633
Synonyms: 7- chloro- N- methyl- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: CNc1cc(Cl)c2c(c1[N+](=O)[O-])non2

STL040634
Synonyms: 2- ethyl- N- [3- (1H- imidazol- 1- yl)propyl][1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: CCc1nc(NCCCn2cncc2)c2c(n1)c1ccccc1o2

STL040642
Synonyms: 6- nitro- 2H- chromene- 2- thione
Smiles: S=c1ccc2c(o1)ccc(c2)[N+](=O)[O-]

STL040644
Synonyms: {(6Z)- 4- amino- 6- [(4- methoxyphenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- yl}methylcyclohexyl(methyl)carbamodithioate
Smiles: COc1ccc(cc1)/N=c\1/[nH]c(CSC(=S)N(C2CCCCC2)C)nc(n1)N

STL040653
Synonyms: 4- {[(1E,2Z)- 2- chloro- 3- phenylprop- 2- en- 1- ylidene]amino}- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Cl/C(=C\c1ccccc1)/C=N/n1c(S)nnc1c1n[nH]c(c1)c1ccccc1

STL040655
Synonyms: N'- [(1E)- 1- (4- hydroxyphenyl)ethylidene]- 2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(s1)C)N/N=C(/c1ccc(cc1)O)\C

STL040669
Synonyms: {[4- ammonio- 5- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetate
Smiles: [O-]C(=O)CSc1nnc(n1[NH3+])c1ccc(cc1)C

STL040672
Synonyms: (5E)- 5- {[(2- ammoniocyclohexyl)amino]methylidene}- 1- (4- methoxyphenyl)- 4,6- dioxo- 1,4,5,6- tetrahydropyrimidine- 2- thiolate
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C\NC2CCCCC2[NH3+])/C1=O)[S-]

STL040688
Synonyms: 2- (dioxidophosphorothioyl)- 2,3- dihydro- 1H- indene- 1- carboxylate
Smiles: [O-]C(=O)C1c2ccccc2CC1P(=S)([O-])[O-]

STL040700
Synonyms: (5E)- 1- (4- fluorobenzyl)- 5- {[(3- hydroxypropyl)amino]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: OCCCN/C=C/1\C(=O)N=C(N(C1=O)Cc1ccc(cc1)F)S

STL040707
Synonyms: N- [(2E)- 6- (piperidin- 1- ylsulfonyl)- 1,3- benzothiazol- 2(3H)- ylidene]pyridine- 4- carboxamide
Smiles: O=C(c1ccncc1)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N1CCCCC1

STL040711
Synonyms: 2- [(6- methoxy- 2- methylquinolin- 4- yl)amino]phenol
Smiles: COc1ccc2c(c1)c(cc(n2)C)Nc1ccccc1O

STL040715
Synonyms: 2- [(E)- {[2- (hydroxymethyl)- 1H- 3,1- benzimidazol- 3- ium- 1- yl]imino}methyl]- 4- nitrophenolate
Smiles: OCc1[nH+]c2c(n1/N=C/c1cc(ccc1[O-])[N+](=O)[O-])cccc2

STL040724
Synonyms: N'- {(1E)- 1- [4- hydroxy- 2,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}pentanehydrazide
Smiles: CCCCC(=O)NN/C(=C/1\C(=NC(=O)N(C1=O)CC=C)O)/C

STL040726
Synonyms: 5- (1H- indol- 3- yl)- N'- [(E)- pyridin- 2- ylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1c[nH]c2c1cccc2)N/N=C/c1ccccn1

STL040728
Synonyms: 6- methoxy- 3- [5- (3- methylphenyl)- 1,2,4- oxadiazol- 3- yl]quinolin- 2(1H)- one
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)c1noc(n1)c1cccc(c1)C

STL040733
Synonyms: 6- hydroxy- 3- methyl- 8- (morpholin- 4- yl)- 7- [2- (pyrimidin- 2- ylsulfanyl)ethyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1n(CCSc1ncccn1)c(n2)N1CCOCC1)C

STL040736
Synonyms: methylN- [(4- fluorobenzyl)carbamoyl]methioninate
Smiles: COC(=O)C(NC(=O)NCc1ccc(cc1)F)CCSC

STL040737
Synonyms: (2Z)- 2- [(2,4- dimethylphenyl)imino]- 7- (4- fluorophenyl)- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: Fc1ccc(cc1)C1CC(=O)c2c(C1)[nH]/c(=N/c1ccc(cc1C)C)/nc2

STL040743
Synonyms: (2E)- 3- {4- [(2- chlorobenzyl)oxy]- 3- methoxyphenyl}- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: COc1cc(ccc1OCc1ccccc1Cl)/C=C(\C(=O)[O-])/Sc1[nH]nc([nH+]1)C

STL040748
Synonyms: 2- [4- (3- ethoxyphenoxy)quinazolin- 1- ium- 2- yl]phenolate
Smiles: CCOc1cccc(c1)Oc1nc([nH+]c2c1cccc2)c1ccccc1[O-]

STL040751
Synonyms: N- [7- (4- chlorophenyl)- 5- oxo- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 2- phenoxypropanamide
Smiles: O=C(C(Oc1ccccc1)C)Nc1nn2c(=NC(=O)CC2c2ccc(cc2)Cl)[nH]1

STL040755
Synonyms: 2- [4- (2- methoxy- 4- methylphenoxy)quinazolin- 1- ium- 2- yl]phenolate
Smiles: COc1cc(C)ccc1Oc1nc([nH+]c2c1cccc2)c1ccccc1[O-]

STL040756
Synonyms: (5Z)- 5- [(benzylamino)methylidene]- 3- (2,3- dimethylphenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C\NCc1ccccc1)c1cccc(c1C)C

STL040768
Synonyms: 6- hydroxy- 3- methyl- 7- (3- methylbutyl)- 8- (3- methylpiperidin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(CCn1c(nc2c1c(O)nc(=O)n2C)N1CCCC(C1)C)C

STL040771
Synonyms: 4- fluoro- N- [(2Z)- 5- (1H- indol- 3- ylmethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: Fc1ccc(cc1)C(=O)/N=c\1/[nH]nc(s1)Cc1c[nH]c2c1cccc2

STL040778
Synonyms: 2- (methoxycarbonyl)- 3- methyl- 2- azabicyclo[2.2.2]oct- 7- ene- 5,6- dicarboxylicacid
Smiles: COC(=O)N1C(C)C2C=CC1C(C2C(=O)O)C(=O)O

STL040784
Synonyms: 5,5'- sulfinylbis(6- hydroxy- 1,3- dimethylpyrimidine- 2,4(1H,3H)- dione)
Smiles: O=S(c1c(O)n(C)c(=O)n(c1=O)C)c1c(O)n(C)c(=O)n(c1=O)C

STL040787
Synonyms: 3- chloro- N- [(2Z)- 3- [(4- fluorobenzyl)amino]quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: Fc1ccc(cc1)CNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)Cl

STL040788
Synonyms: 2- [(4- hydroxy- 6- phenylpyrimidin- 2- yl)sulfanyl]- N- {4- [(4- methylpyrimidin- 2- yl)sulfamoyl]phenyl}acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nccc(n1)C)CSc1nc(O)cc(n1)c1ccccc1

STL040794
Synonyms: 6- hydroxy- 5- [(5- methylthiophen- 2- yl)methyl]- 5- [2- (pyridin- 4- yl)ethyl]pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1NC(=O)C(C(=N1)O)(CCc1ccncc1)Cc1ccc(s1)C

STL040801
Synonyms: methylN- (pyrrolidin- 1- ylcarbonyl)isoleucinate
Smiles: CCC(C(C(=O)OC)NC(=O)N1CCCC1)C

STL040805
Synonyms: (2Z)- 3- (5- chloro- 2- ethoxyphenyl)- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: CCOc1ccc(cc1/C=C(/C(=O)[O-])\Sc1[nH]nc([nH+]1)C)Cl

STL040813
Synonyms: (5E)- 6- hydroxy- 3- phenyl- 5- [1- (2- phenylhydrazinyl)ethylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: C/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1)O)/NNc1ccccc1

STL040818
Synonyms: 3- [5- (4- methylphenyl)- 1,2,4- oxadiazol- 3- yl]quinolin- 2(1H)- one
Smiles: Cc1ccc(cc1)c1onc(n1)c1cc2ccccc2[nH]c1=O

STL040837
Synonyms: 3- [(furan- 2- ylmethyl)ammonio]- 4- oxo- 4- {[3- (trifluoromethyl)phenyl]amino}butanoate
Smiles: [O-]C(=O)CC(C(=O)Nc1cccc(c1)C(F)(F)F)[NH2+]Cc1ccco1

STL040839
Synonyms: 2,3- dihydro- 1H- inden- 2- yl[furan- 2- yl(hydroxy)methyl]phosphinate
Smiles: OC(P(=O)(C1Cc2c(C1)cccc2)[O-])c1ccco1

STL040842
Synonyms: 5- ethyl- 1- [(3- fluorophenyl)carbonyl]- 2- hydroxy- 5- phenylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCC1(c2ccccc2)C(=O)N=C(N(C1=O)C(=O)c1cccc(c1)F)O

STL040846
Synonyms: 1- (3- hexyl- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl)- 3- (4- methylphenoxy)propan- 2- ol
Smiles: CCCCCCn1c(=N)n(c2c1cccc2)CC(COc1ccc(cc1)C)O

STL040858
Synonyms: N- [(3E)- 6- methoxy- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 2- phenoxyacetamide
Smiles: COc1ccc2c(c1)cc1c(n2)n([nH]/c/1=N/C(=O)COc1ccccc1)CC(C)C

STL040859
Synonyms: tert- butyl(1- {(2E)- 2- [(2,4- dihydroxy- 6- methylpyrimidin- 5- yl)methylidene]hydrazinyl}- 1- oxopropan- 2- yl)carbamate(non- preferredname)
Smiles: O=C(OC(C)(C)C)NC(C(=O)N/N=C/c1c(C)nc(nc1O)O)C

STL040867
Synonyms: 2,4- dichloro- N- [(2E)- 5- [2- (piperidin- 1- yl)ethyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)/N=c/1\[nH]nc(s1)CCN1CCCCC1

STL040873
Synonyms: 1- ({5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- 3,3- dimethylbutan- 2- one
Smiles: COc1ccc(cc1)n1c(nnc1SCC(=O)C(C)(C)C)COc1ccc(cc1)Cl

STL040892
Synonyms: 2- methyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: Cc1nc(N)c2c(n1)c1ccccc1o2

STL040894
Synonyms: 1- {5- [(4- fluorobenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}- 2- (1H- indol- 3- yl)ethanamine
Smiles: Fc1ccc(cc1)CSc1nnc(o1)C(Cc1c[nH]c2c1cccc2)N

STL040899
Synonyms: 2- methylpropyl[(2E)- 5- [(2- fluorophenoxy)methyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]carbamate
Smiles: CC(COC(=O)/N=c/1\[nH]nc(s1)COc1ccccc1F)C

STL040901
Synonyms: (2E)- 2- (1,3- benzoxazol- 2- ylimino)- N- (2- methoxyphenyl)- 4- methyl- 1,2- dihydropyrimidine- 5- carboxamide
Smiles: COc1ccccc1NC(=O)c1c[nH]/c(=N\c2nc3c(o2)cccc3)/nc1C

STL040905
Synonyms: N- (3- benzyl- 2- hydroxy- 7- methyl- 4- oxo- 3,4- dihydrobenzo[g]pteridin- 8- yl)- 2,2,2- trifluoroacetamide
Smiles: O=C(C(F)(F)F)Nc1cc2nc3nc(O)n(c(=O)c3nc2cc1C)Cc1ccccc1

STL040912
Synonyms: 8- (dimethylamino)- 6- hydroxy- 7- (2- hydroxyethyl)- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCn1c(nc2c1c(O)nc(=O)n2C)N(C)C

STL040914
Synonyms: (5E)- 2,6- dihydroxy- 5- (1- {[3- (trifluoromethyl)phenyl]amino}ethylidene)pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C(/Nc2cccc(c2)C(F)(F)F)\C)/C(=N1)O

STL040915
Synonyms: 1- (3,4- dimethylphenyl)- 4- hydroxy- 7- methyl- 5,5- bis(trifluoromethyl)- 5,8- dihydropyrimido[4,5- d]pyrimidin- 2(1H)- one
Smiles: CC1=NC(c2c(N1)n(c1ccc(c(c1)C)C)c(=O)nc2O)(C(F)(F)F)C(F)(F)F

STL040918
Synonyms: 2- (5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 1,3,4- oxadiazol- 2- yl)ethanamine
Smiles: NCCc1nnc(o1)SC/C=C/c1ccccc1

STL040926
Synonyms: 2- chloro- N- (2- formyl- 1H- indol- 3- yl)- N- (4- nitrophenyl)acetamide
Smiles: ClCC(=O)N(c1c(C=O)[nH]c2c1cccc2)c1ccc(cc1)[N+](=O)[O-]

STL040927
Synonyms: N- [(2Z)- 3- [(2- chlorobenzyl)amino]quinoxalin- 2(1H)- ylidene]- 3,4- dimethylbenzenesulfonamide
Smiles: Clc1ccccc1CNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(c(c1)C)C

STL040928
Synonyms: N- [(2Z)- 3- [4- (2- ethoxyphenyl)piperazin- 1- yl]- 4- hydroxy- 1- oxonaphthalen- 2(1H)- ylidene]thiophene- 2- sulfonamide
Smiles: CCOc1ccccc1N1CCN(CC1)C1=C(O)c2c(C(=O)/C/1=N\S(=O)(=O)c1cccs1)cccc2

STL040935
Synonyms: N- [(2E)- 4- (thiophen- 2- yl)- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=c\1/scc([nH]1)c1cccs1

STL040936
Synonyms: 1- {5- [(3- fluorobenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}- 2- methylpropan- 1- amine
Smiles: CC(C(c1nnc(o1)SCc1cccc(c1)F)N)C

STL040946
Synonyms: (4E)- 1- [5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 4- [hydroxy(phenyl)methylidene]- 5- (thiophen- 2- yl)pyrrolidine- 2,3- dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1cccs1)c1nnc(s1)SCc1ccccc1)/c1ccccc1

STL040949
Synonyms: 3- (4- methoxyphenyl)- N- {1- [2- (4- methoxyphenyl)ethyl]- 6,6- dimethyl- 2,4- dioxo- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl}propanamide
Smiles: COc1ccc(cc1)CCC(=O)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)CCc1ccc(cc1)OC)C(F)(F)F

STL040960
Synonyms: (E)- N- (4- tert- butyl- 1,3- thiazol- 2(3H)- ylidene)- N~2~- (furan- 2- ylmethyl)- alpha- asparagine
Smiles: OC(=O)CC(C(=O)/N=c\1/scc([nH]1)C(C)(C)C)NCc1ccco1

STL040976
Synonyms: (5Z)- 5- {1- [(4- fluorobenzyl)amino]ethylidene}- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C(\NCc2ccc(cc2)F)/C)/C(=N1)O

STL040980
Synonyms: 4- (4- benzylpiperazin- 1- yl)- 4- oxo- N- [(2Z)- 5- propyl- 1,3,4- thiadiazol- 2(3H)- ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)Cc2ccccc2)/s1

STL040982
Synonyms: 2- {[5- (1- aminoethyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- N,N- dimethylacetamide
Smiles: O=C(N(C)C)CSc1nnc(o1)C(N)C

STL040987
Synonyms: (5E)- 1- (butan- 2- yl)- 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)C(CC)C)S

STL040988
Synonyms: 5- oxo- 2- phenyl- N- [(2Z)- 1,3,4- thiadiazol- 2(3H)- ylidene]tetrahydrofuran- 3- carboxamide
Smiles: O=C1CC(C(O1)c1ccccc1)C(=O)/N=c/1\scn[nH]1

STL040998
Synonyms: 2- chloro- 4- (1,3- dimethyl- 2,4- dioxo- 8- phenyl- 2,3,4,8- tetrahydro- 1H- imidazo[2,1- f]purin- 9- ium- 7- yl)phenolate
Smiles: [O-]c1ccc(cc1Cl)c1cn2c(n1c1ccccc1)[nH+]c1c2c(=O)n(C)c(=O)n1C

STL041003
Synonyms: 3- [(2- methyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)amino]propan- 1- ol
Smiles: OCCCNc1nc(C)nc2c1oc1c2cccc1

STL041006
Synonyms: 3- (4- methoxyphenyl)- 1- (2- methylbenzyl)- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: COc1ccc(cc1)c1cn(c2[n+]1CCC2)Cc1ccccc1C

STL041014
Synonyms: 1'- (3- chlorophenyl)- 2'- hydroxy- 3- phenyl- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: Clc1cccc(c1)N1C(=NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)c1ccccc1)O

STL041016
Synonyms: {[5- (4- tert- butylphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 2- ium- 3- yl]sulfanyl}acetate
Smiles: C=CCn1c(n[nH+]c1SCC(=O)[O-])c1ccc(cc1)C(C)(C)C

STL041017
Synonyms: 5- benzyl- 3- [3- (2- oxopyrrolidin- 1- yl)propyl]imidazolidine- 2,4- dione
Smiles: O=C1NC(C(=O)N1CCCN1CCCC1=O)Cc1ccccc1

STL041025
Synonyms: (4Z)- 6- [(4- methylpiperazin- 1- yl)methyl]- 4- (phenylimino)- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: CN1CCN(CC1)Cc1nc(N)n/c(=N\c2ccccc2)/[nH]1

STL041027
Synonyms: 3- {[(3Z)- 3- {[(2,4- dimethylphenyl)sulfonyl]imino}- 3,4- dihydroquinoxalin- 2- yl]amino}benzoicacid
Smiles: Cc1ccc(c(c1)C)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1cccc(c1)C(=O)O

STL041034
Synonyms: N- [(3Z)- 1,7- dimethyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pyridine- 2- carboxamide
Smiles: Cc1ccc2c(c1)nc1c(c2)/c(=N/C(=O)c2ccccn2)/[nH]n1C

STL041041
Synonyms: N- [(2E)- 5- (phenoxymethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]furan- 2- carboxamide
Smiles: O=C(c1ccco1)/N=c/1\[nH]nc(s1)COc1ccccc1

STL041046
Synonyms: 7- chloro- 4- nitro- 5- (piperidin- 1- yl)- 2,1,3- benzoxadiazole
Smiles: Clc1cc(N2CCCCC2)c(c2c1non2)[N+](=O)[O-]

STL041048
Synonyms: N- [(3Z)- 1,7- dimethyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]propanamide
Smiles: CCC(=O)/N=c/1\[nH]n(c2c1cc1ccc(cc1n2)C)C

STL041050
Synonyms: 3- (4- methoxyphenyl)- 1- [1- (4- methoxyphenyl)- 1- oxopropan- 2- yl]- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: COc1ccc(cc1)C(=O)C(n1cc([n+]2c1CCC2)c1ccc(cc1)OC)C

STL041058
Synonyms: N- [(2Z)- 4- hydroxy- 5,5- dimethyl- 1,3- thiazol- 2(5H)- ylidene]octanamide
Smiles: CCCCCCCC(=O)/N=C\1/N=C(C(S1)(C)C)O

STL041061
Synonyms: (5Z)- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5- {[(2- hydroxyethyl)amino]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: OCCN/C=C\1/C(=O)N=C(N(C1=O)CCC1=CCCCC1)S

STL041065
Synonyms: 1- [2- (3,4- dichlorophenyl)- 2- oxoethyl]- 3- (4- methylphenyl)- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: Cc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)c1ccc(c(c1)Cl)Cl

STL041071
Synonyms: 4- [(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/c1ccc(cc1)[O-]

STL041076
Synonyms: 2- ethyl4- methyl5- {3- [5- (4- fluorophenyl)furan- 2- yl]- 4,6- dioxo- 2- phenylhexahydro- 5H- pyrrolo[3,4- d][1,2]oxazol- 5- yl}- 3- methylthiophene- 2,4- dicarboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C(=O)OC)N1C(=O)C2C(C1=O)ON(C2c1ccc(o1)c1ccc(cc1)F)c1ccccc1

STL041079
Synonyms: (2Z)- 3- [4- (benzyloxy)- 3- ethoxyphenyl]- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: CCOc1cc(ccc1OCc1ccccc1)/C=C(/C(=O)[O-])\Sc1[nH]nc([nH+]1)C

STL041089
Synonyms: (5Z)- 5- {1- [(1- benzylpiperidinium- 4- yl)amino]ethylidene}- 2- hydroxy- 6- oxo- 5,6- dihydropyrimidin- 4- olate
Smiles: OC1=NC(=O)/C(=C(\NC2CC[NH+](CC2)Cc2ccccc2)/C)/C(=N1)[O-]

STL041106
Synonyms: (4Z)- 6- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 4- (phenylimino)- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc(N)n/c(=N\c2ccccc2)/[nH]1

STL041125
Synonyms: 1- (1- phenylethyl)- 1H- benzimidazol- 3- ium- 2- sulfonate
Smiles: CC(n1c2ccccc2[nH+]c1S(=O)(=O)[O-])c1ccccc1

STL041136
Synonyms: 4- (2- methoxyphenyl)- 1- (pentan- 3- yl)- 4,6- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepine- 3,7- diol
Smiles: CCC(n1nc(c2c1N=C(O)CSC2c1ccccc1OC)O)CC

STL041142
Synonyms: 4- [(3- {(2Z)- 2- [(2E)- (2,4- dichlorobenzylidene)hydrazinylidene]- 2,3- dihydro- 1,3- thiazol- 4- yl}phenyl)sulfonyl]- 2,6- dimethylmorpholine
Smiles: CC1OC(C)CN(C1)S(=O)(=O)c1cccc(c1)c1cs/c(=N\N=C\c2ccc(cc2Cl)Cl)/[nH]1

STL041156
Synonyms: 6- hydroxy- 3- methyl- 7- propyl- 8- [(2E)- 2- (pyridin- 4- ylmethylidene)hydrazinyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCn1c(N/N=C/c2ccncc2)nc2c1c(O)nc(=O)n2C

STL041157
Synonyms: N- [(2Z)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxo- 4- [4- (pyridin- 2- yl)piperazin- 1- yl]butanamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)c2ccccn2)/s1)C

STL041171
Synonyms: N- [(2Z)- 3- (prop- 2- en- 1- ylamino)quinoxalin- 2(1H)- ylidene]thiophene- 2- sulfonamide
Smiles: C=CCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccs1

STL041179
Synonyms: 2- [(4- chlorophenyl)amino]- 4H- pyrido[3,2- e][1,3]thiazin- 4- one
Smiles: Clc1ccc(cc1)Nc1nc(=O)c2c(s1)nccc2

STL041200
Synonyms: (2E)- 2- [(2,4- dimethylphenyl)imino]- 7- (4- methylphenyl)- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: Cc1ccc(cc1)C1CC(=O)c2c(C1)[nH]/c(=N\c1ccc(cc1C)C)/nc2

STL041205
Synonyms: (2Z)- 3- {2- [(2- fluorobenzyl)oxy]phenyl}- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: [O-]C(=O)/C(=C/c1ccccc1OCc1ccccc1F)/Sc1[nH]nc([nH+]1)C

STL041209
Synonyms: 4- {[(E)- (2,3- dichlorophenyl)methylidene]amino}- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1/N=C/c1cccc(c1Cl)Cl)c1n[nH]c(c1)c1ccccc1

STL041215
Synonyms: 6'- amino- 3'- ethyl- 2- methyl- 4,5- dihydro- 2'H- spiro[furan- 3,4'- pyrano[2,3- c]pyrazole]- 5'- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31CCOC3C)c(CC)[nH]n2

STL041226
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 6- hydroxy- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)N=C(CC1c1ccc(cc1)Cl)O

STL041228
Synonyms: 2- [5'- (naphthalen- 2- yl)- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]acetamide
Smiles: NC(=O)CC1NC2(C3C1C(=O)N(C3=O)c1ccc3c(c1)cccc3)C(=O)Nc1c2cccc1

STL041230
Synonyms: (5Z)- 5- {1- [(4- fluorophenyl)amino]ethylidene}- 6- hydroxy- 3- (4- methoxyphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(/Nc2ccc(cc2)F)\C)/C1=O)O

STL041235
Synonyms: N- [(2Z)- 3- [(3- methoxypropyl)amino]quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: COCCCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccccc1

STL041242
Synonyms: 2- [4- (2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)piperazin- 1- yl]ethanol
Smiles: OCCN1CCN(CC1)c1nc(CC)nc2c1oc1c2cccc1

STL041244
Synonyms: ethyl2- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 4- [(4- nitrophenyl)amino]pyrimidine- 5- carboxylate
Smiles: CCOC(=O)c1cnc(nc1Nc1ccc(cc1)[N+](=O)[O-])n1nc(cc1C)C

STL041250
Synonyms: 2- {[5- (1- amino- 2- methylpropyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}acetamide
Smiles: NC(c1nnc(o1)SCC(=O)N)C(C)C

STL041251
Synonyms: 2- [4- (4- chlorophenoxy)quinazolin- 1- ium- 2- yl]phenolate
Smiles: Clc1ccc(cc1)Oc1nc([nH+]c2c1cccc2)c1ccccc1[O-]

STL041260
Synonyms: N- (2- bromophenyl)- 2- {[5- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2Br)nnc1c1cccc(c1)OC

STL041271
Synonyms: N- [(3Z)- 1- butyl- 7- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 4- ethoxybenzamide
Smiles: CCCCn1[nH]/c(=N\C(=O)c2ccc(cc2)OCC)/c2c1nc1cc(C)ccc1c2

STL041272
Synonyms: 1- (4- chlorophenyl)- 2- oxo- 2- phenylethyl2- oxo- 1,2- dihydroquinoline- 4- carboxylate
Smiles: Clc1ccc(cc1)C(C(=O)c1ccccc1)OC(=O)c1cc(=O)[nH]c2c1cccc2

STL041276
Synonyms: N,N'- butane- 1,4- diylbis(5- hydroxypyridine- 3- carboxamide)
Smiles: Oc1cncc(c1)C(=O)NCCCCNC(=O)c1cncc(c1)O

STL041283
Synonyms: 8- [(dimethylammonio)methyl]- 2- methyl- 4- oxo- 3- [4- (propoxycarbonyl)phenoxy]- 4H- chromen- 7- olate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+](C)C)[O-]

STL041285
Synonyms: 2- ({5- [1- amino- 2- (1H- indol- 3- yl)ethyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- N- (2- ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(o1)C(Cc1c[nH]c2c1cccc2)N

STL041302
Synonyms: N- (5- oxo- 7- phenyl- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)butanamide
Smiles: CCCC(=O)Nc1nn2c(=NC(=O)CC2c2ccccc2)[nH]1

STL041304
Synonyms: 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)- N'- [(E)- (2,4,6- trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(OC)cc(c1/C=N/NC(=O)Cn1nc(cc1C)[N+](=O)[O-])OC

STL041307
Synonyms: 2- (phenoxymethyl)- 12- phenyl- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 3- ium- 9- olate
Smiles: [O-]c1ccc2c(c1)Oc1c(C2c2ccccc2)c2nc([nH+]n2cn1)COc1ccccc1

STL041309
Synonyms: 2- [(3- methylbenzyl)sulfanyl]- 5- (pyrrolidin- 2- yl)- 1,3,4- oxadiazole
Smiles: Cc1cccc(c1)CSc1nnc(o1)C1CCCN1

STL041311
Synonyms: (8E)- 7- [(2E)- 3- chlorobut- 2- en- 1- yl]- 8- [(2Z)- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)hydrazinylidene]- 1,3- dimethyl- 3,7,8,9- tetrahydro- 1H- purine- 2,6- dione
Smiles: C/C(=C\Cn1/c(=N/N=C\2/C(=NC(=NC2=O)O)O)/[nH]c2c1c(=O)n(c(=O)n2C)C)/Cl

STL041313
Synonyms: (5Z)- 1- (4- fluorophenyl)- 5- [4- (morpholin- 4- ium- 4- yl)benzylidene]- 4,6- dioxo- 1,4,5,6- tetrahydropyrimidine- 2- thiolate
Smiles: Fc1ccc(cc1)N1C(=NC(=O)/C(=C/c2ccc(cc2)[NH+]2CCOCC2)/C1=O)[S-]

STL041344
Synonyms: 4- [(3- fluorophenyl)amino]- 3- [(furan- 2- ylmethyl)ammonio]- 4- oxobutanoate
Smiles: [O-]C(=O)CC(C(=O)Nc1cccc(c1)F)[NH2+]Cc1ccco1

STL041351
Synonyms: tert- butyl{3- [(2E)- 2- (2H- chromen- 3- ylmethylidene)hydrazinyl]- 3- oxopropyl}carbamate(non- preferredname)
Smiles: O=C(N/N=C/C1=Cc2c(OC1)cccc2)CCNC(=O)OC(C)(C)C

STL041361
Synonyms: (2Z)- 2- [(4- ethylphenyl)imino]- 7- (furan- 2- yl)- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: CCc1ccc(cc1)/N=c/1\ncc2c([nH]1)CC(CC2=O)c1ccco1

STL041363
Synonyms: 4- methoxy- N- [(4Z)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(1H)- ylidene]aniline
Smiles: COc1ccc(cc1)/N=c/1\nc[nH]c2c1c1CCCCc1s2

STL041368
Synonyms: (5E)- 1- (4- chlorophenyl)- 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)c1ccc(cc1)Cl)[O-])/NCc1ccc[nH+]c1

STL041389
Synonyms: (1E)- 1- [(4- ethoxyphenyl)imino]- 3- propyl- 1,5- dihydropyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCCc1c/c(=N\c2ccc(cc2)OCC)/n2c(c1C#N)[nH]c1c2cccc1

STL041393
Synonyms: (5E)- 4,6- dioxo- 1- (prop- 2- en- 1- yl)- 5- ({[4- (pyridinium- 4- ylmethyl)phenyl]amino}methylidene)- 1,4,5,6- tetrahydropyrimidine- 2- thiolate
Smiles: C=CCN1C(=NC(=O)/C(=C\Nc2ccc(cc2)Cc2cc[nH+]cc2)/C1=O)[S-]

STL041405
Synonyms: 3- (5- tert- butyl- 1,2,4- oxadiazol- 3- yl)- 6- methoxyquinolin- 2(1H)- one
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)c1noc(n1)C(C)(C)C

STL041408
Synonyms: (2E)- 2- {(2E)- [1- (4- bromophenyl)ethylidene]hydrazinylidene}- 3- hydroxy- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: Brc1ccc(cc1)/C(=N/N=c/1\[nH]c2ccccc2c(=O)n1O)/C

STL041412
Synonyms: N- (5- oxo- 7- phenyl- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)- 2- phenoxypropanamide
Smiles: O=C1N=c2[nH]c(nn2C(C1)c1ccccc1)NC(=O)C(Oc1ccccc1)C

STL041443
Synonyms: (4E)- 4- [hydroxy(phenyl)methylidene]- 5- (3- nitrophenyl)- 1- (tetrahydrofuran- 2- ylmethyl)pyrrolidine- 2,3- dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CC1CCCO1)/c1ccccc1

STL041462
Synonyms: (5Z)- 1- butyl- 5- {[1- (4- fluorophenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCCCN1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)F)C)/C1=O)S

STL041473
Synonyms: 1- {2- [(2,3- dimethylphenyl)amino]- 2- oxoethyl}- 3- (4- methylphenyl)- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: Cc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)Nc1cccc(c1C)C

STL041481
Synonyms: 3- methyl- N- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]- N- phenylbenzamide
Smiles: Cc1cccc(c1)C(=O)N(c1ccccc1)Cc1cc(=O)[nH]c2c1cccc2

STL041493
Synonyms: 4- hydroxy- 7- (4- methoxyphenyl)- 1- phenyl- 5,5- bis(trifluoromethyl)- 5,8- dihydropyrimido[4,5- d]pyrimidin- 2(1H)- one
Smiles: COc1ccc(cc1)C1=NC(c2c(N1)n(c1ccccc1)c(=O)nc2O)(C(F)(F)F)C(F)(F)F

STL041496
Synonyms: (2Z)- N~6~- (4- chlorophenyl)- 2- [(3- chlorophenyl)imino]- 5- nitro- 1,2- dihydropyrimidine- 4,6- diamine
Smiles: Clc1ccc(cc1)Nc1[nH]/c(=N/c2cccc(c2)Cl)/nc(c1[N+](=O)[O-])N

STL041497
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- (4- propoxyphenyl)pyrrolidin- 3- ylidene}(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL041500
Synonyms: 5- methoxy- 2- [4- (2- methyl- 1,3- thiazol- 4- yl)- 1H- pyrazol- 5- yl]phenol
Smiles: COc1ccc(c(c1)O)c1[nH]ncc1c1csc(n1)C

STL041518
Synonyms: (2Z)- 3- [4- (benzyloxy)- 3- methoxyphenyl]- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: COc1cc(ccc1OCc1ccccc1)/C=C(/C(=O)[O-])\Sc1[nH]nc([nH+]1)C

STL041519
Synonyms: 2- ({5- [(1S)- 1- amino- 3- methylbutyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- N- (2,3- dimethylphenyl)acetamide
Smiles: CC(C[C@@H](c1nnc(o1)SCC(=O)Nc1cccc(c1C)C)N)C

STL041525
Synonyms: 5- [(5- chloro- 2- ethoxybenzyl)sulfanyl]- 3- ethyl- 1H- 1,2,4- triazole
Smiles: CCOc1ccc(cc1CSc1[nH]nc(n1)CC)Cl

STL041526
Synonyms: 4- (4- hydroxy- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)c1nc(O)c2c(n1)sc1c2CCCC1

STL041548
Synonyms: (2E)- 3- (3- chloro- 4,5- dimethoxyphenyl)- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: COc1c(Cl)cc(cc1OC)/C=C(\C(=O)[O-])/Sc1[nH]nc([nH+]1)C

STL041564
Synonyms: 4- [(2E)- 2- ({2- [(4- chlorobenzyl)oxy]naphthalen- 1- yl}methylidene)hydrazinyl]benzoicacid
Smiles: Clc1ccc(cc1)COc1ccc2c(c1/C=N/Nc1ccc(cc1)C(=O)O)cccc2

STL041566
Synonyms: (2E)- 4- [4- (diphenylmethyl)piperazin- 4- ium- 1- yl]- 4- oxobut- 2- enoate
Smiles: [O-]C(=O)/C=C/C(=O)N1CC[NH+](CC1)C(c1ccccc1)c1ccccc1

STL041577
Synonyms: 3- {[(4- ethoxyphenyl)amino]methyl}- 6- methoxyquinolin- 2(1H)- one
Smiles: CCOc1ccc(cc1)NCc1cc2cc(OC)ccc2[nH]c1=O

STL041580
Synonyms: 3- (4- methoxyphenyl)- 4- oxo- 8- (pyrrolidinium- 1- ylmethyl)- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: COc1ccc(cc1)c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCCC1)[O-]

STL041586
Synonyms: 6- methoxy- 3- (5- methyl- 1,2,4- oxadiazol- 3- yl)quinolin- 2(1H)- one
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)c1noc(n1)C

STL041598
Synonyms: (8E)- 3,7- dimethyl- 1- (4- methylbenzyl)- 8- [(2E)- (pyridin- 2- ylmethylidene)hydrazinylidene]- 3,7,8,9- tetrahydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)/c(=N/N=C/c1ccccn1)/[nH]2

STL041602
Synonyms:
Smiles: O=S(=O)(c1cccc2c1nsn2)/N=c/1\[nH]c2ccccc2nc1NC1CCCCC1

STL041610
Synonyms: 4- {[bis(2- methoxyethyl)ammonio]methyl}- 7- methyl- 2- oxo- 2H- chromen- 6- olate
Smiles: COCC[NH+](Cc1cc(=O)oc2c1cc([O-])c(c2)C)CCOC

STL041619
Synonyms: 4,7,9- trimethyl- 3- phenyl- 4,10- dihydro[1,2,4]triazino[3,4- f]purine- 6,8(7H,9H)- dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n1c(=NN=C(C1C)c1ccccc1)[nH]2

STL041633
Synonyms: (5Z)- 5- [1- (2,3- dihydro- 1H- inden- 5- ylamino)ethylidene]- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C(\Nc2ccc3c(c2)CCC3)/C)/C(=N1)O

STL041638
Synonyms: 6- (3,4- dichlorophenyl)- 3- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine
Smiles: Clc1cc(ccc1Cl)C1=Nn2c(SC1)nnc2c1[nH]nc2c1CCC2

STL041641
Synonyms: 3- {[(3Z)- 3- {[(4- fluorophenyl)sulfonyl]imino}- 3,4- dihydroquinoxalin- 2- yl]amino}benzoicacid
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1cccc(c1)C(=O)O

STL041660
Synonyms:
Smiles: CCC([C@@H](C(=O)N/N=C/c1c(C)[nH]c(=O)[nH]c1=O)NC(=O)OC(C)(C)C)C

STL041665
Synonyms: 7- phenyl- 3- (thiophen- 2- yl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: c1ccc(cc1)n1ncc2c1ncn1c2nnc1c1cccs1

STL041668
Synonyms: 3- {(3E)- 3- [hydroxy(4- methoxyphenyl)methylidene]- 4,5- dioxo- 2- phenylpyrrolidin- 1- yl}benzoicacid
Smiles: COc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1cccc(c1)C(=O)O)/O

STL041672
Synonyms: 4- {[(1E)- 1- (1- benzyl- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)ethyl]amino}benzoicacid
Smiles: O=C1N=C(O)/C(=C(\Nc2ccc(cc2)C(=O)O)/C)/C(=O)N1Cc1ccccc1

STL041681
Synonyms: ethyl4- {5- [(Z)- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)methyl]furan- 2- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C\1/C(=NC(=NC1=O)O)O

STL041683
Synonyms: (5E)- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5- [(morpholin- 4- ium- 4- ylamino)methylidene]- 4,6- dioxo- 1,4,5,6- tetrahydropyrimidine- 2- thiolate
Smiles: [S-]C1=NC(=O)/C(=C\N[NH+]2CCOCC2)/C(=O)N1CCC1=CCCCC1

STL041687
Synonyms: 9- (3,5- dimethylphenyl)- 4,7- dihydroxy- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purin- 2(1H)- one
Smiles: OC1CN(c2cc(C)cc(c2)C)c2n(C1)c1c(O)nc(=O)n(c1n2)C

STL041688
Synonyms: (5E)- 1- [2- (3,4- dimethoxyphenyl)ethyl]- 5- {[(4- methylpiperazin- 4- ium- 1- yl)amino]methylidene}- 2,6- dioxo- 1,2,5,6- tetrahydropyrimidin- 4- olate
Smiles: COc1cc(CCN2C(=O)N=C(/C(=C\NN3CC[NH+](CC3)C)/C2=O)[O-])ccc1OC

STL041698
Synonyms: methyl3- {[(1E)- 1- (6- hydroxy- 1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)ethylidene]amino}benzoate
Smiles: COC(=O)c1cccc(c1)/N=C(/c1c(O)n(C)c(=O)n(c1=O)C)\C

STL041702
Synonyms: methylN- (benzylcarbamoyl)- L- valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)NCc1ccccc1

STL041706
Synonyms: 6- hydroxy- 7- (2- hydroxyethyl)- 3- methyl- 8- [(4- methylbenzyl)amino]- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCn1c(NCc2ccc(cc2)C)nc2c1c(O)nc(=O)n2C

STL041734
Synonyms: N- benzyl- 2- [(4- ethoxyphenyl)amino]- 6- hydroxy- 4,5- dihydropyrimidine- 4- carboxamide
Smiles: CCOc1ccc(cc1)NC1=NC(CC(=N1)O)C(=O)NCc1ccccc1

STL041739
Synonyms: 2- ({(2Z)- 6- amino- 2- [(3- chlorophenyl)imino]- 5- nitro- 2,3- dihydropyrimidin- 4- yl}amino)ethanol
Smiles: OCCNc1[nH]/c(=N/c2cccc(c2)Cl)/nc(c1[N+](=O)[O-])N

STL041760
Synonyms: (5Z)- 5- {[1- (4- fluorophenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 1- methyl- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Fc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=C(N(C1=O)C)S

STL041761
Synonyms: N- [(2E)- 5- cyclopentyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- (2- methoxyphenoxy)acetamide
Smiles: COc1ccccc1OCC(=O)/N=c/1\[nH]nc(s1)C1CCCC1

STL041770
Synonyms: N- [7- (4- chlorophenyl)- 5- oxo- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]pyridine- 3- carboxamide
Smiles: Clc1ccc(cc1)C1CC(=O)N=c2n1nc([nH]2)NC(=O)c1cccnc1

STL041777
Synonyms: 1- cyclopentyl- 4- (2- methoxyphenyl)- 4,6- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepine- 3,7- diol
Smiles: COc1ccccc1C1SCC(=Nc2c1c(O)nn2C1CCCC1)O

STL041782
Synonyms: (2Z)- 3- {4- [(4- chlorobenzyl)oxy]- 3- methoxyphenyl}- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: COc1cc(ccc1OCc1ccc(cc1)Cl)/C=C(/C(=O)[O-])\Sc1[nH]nc([nH+]1)C

STL041783
Synonyms: 4- {3- [(3,4- dimethoxyphenyl)amino]imidazo[1,2- a]pyridin- 2- yl}- 6- methoxyisoquinolin- 3(2H)- one
Smiles: COc1ccc2c(c1)c(c(=O)[nH]c2)c1nc2n(c1Nc1ccc(c(c1)OC)OC)cccc2

STL041784
Synonyms: 4- hydroxy- N'- [(3Z)- 2- oxo- 1- (3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]benzohydrazide
Smiles: Oc1ccc(cc1)C(=O)N/N=C\1/c2ccccc2N(C1=O)C1OC(=O)c2c1cccc2

STL041791
Synonyms: (5Z)- 1- (1,3- benzodioxol- 5- yl)- 5- {[1- (butan- 2- yl)- 1H- indol- 3- yl]methylidene}- 2- hydroxypyrimidine- 4,6(1H,5H)- dione
Smiles: CCC(n1cc(c2c1cccc2)/C=C\1/C(=O)N=C(N(C1=O)c1ccc2c(c1)OCO2)O)C

STL041796
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (2- methoxynaphthalen- 1- yl)methylidene]- 5- (4- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc2c(c1/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)cccc2

STL041807
Synonyms: (2Z)- N~6~- (3- fluorophenyl)- 2- [(3- fluorophenyl)imino]- 5- nitro- 1,2- dihydropyrimidine- 4,6- diamine
Smiles: Fc1cccc(c1)Nc1[nH]/c(=N/c2cccc(c2)F)/nc(c1[N+](=O)[O-])N

STL041808
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (4- chloro- 3- nitrophenyl)- 5,7- dimethyl- 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: Cc1cc(C)c2c(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

STL041811
Synonyms: (5E)- 3- butyl- 6- hydroxy- 5- {1- [(tetrahydrofuran- 2- ylmethyl)amino]ethylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: CCCCN1C(=O)N=C(/C(=C(\NCC2CCCO2)/C)/C1=O)O

STL041815
Synonyms: N- [(4E)- [1]benzofuro[3,2- d]pyrimidin- 4(3H)- ylidene]- 2- methoxy- 5- methylaniline
Smiles: COc1ccc(cc1/N=c\1/[nH]cnc2c1oc1c2cccc1)C

STL041820
Synonyms: (4- {(Z)- [2- (4- chlorobenzyl)- 5- iminio- 7- oxo- 5H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 6(7H)- ylidene]methyl}phenoxy)acetate
Smiles: [O-]C(=O)COc1ccc(cc1)/C=C/1\C(=O)N=c2n(C1=[NH2+])nc(s2)Cc1ccc(cc1)Cl

STL041821
Synonyms: 2- chloro- N- (4- methylphenyl)- N- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]acetamide
Smiles: ClCC(=O)N(c1ccc(cc1)C)Cc1cc(=O)[nH]c2c1cccc2

STL041822
Synonyms: 2- chloro- N- (2- methoxyphenyl)- 5- nitropyrimidine- 4,6- diamine
Smiles: COc1ccccc1Nc1nc(Cl)nc(c1[N+](=O)[O-])N

STL041841
Synonyms: (5E)- 1- cycloheptyl- 5- ({[2- (dimethylammonio)ethyl]amino}methylidene)- 2,6- dioxo- 1,2,5,6- tetrahydropyrimidin- 4- olate
Smiles: C[NH+](CCN/C=C/1\C(=NC(=O)N(C1=O)C1CCCCCC1)[O-])C

STL041845
Synonyms: 8- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 3- (2- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(C)c(c2=O)Oc1ccccc1OC

STL041872
Synonyms: (2Z)- 2- [(4- methoxyphenyl)imino]- 7- phenyl- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: COc1ccc(cc1)/N=c/1\ncc2c([nH]1)CC(CC2=O)c1ccccc1

STL041878
Synonyms: 2- {[(2E)- 6- ethoxy- 4- methylquinazolin- 2(1H)- ylidene]amino}- 7- (4- methoxyphenyl)- 7,8- dihydroquinazolin- 5(6H)- one
Smiles: CCOc1ccc2c(c1)c(C)n/c(=N/c1ncc3c(n1)CC(CC3=O)c1ccc(cc1)OC)/[nH]2

STL041897
Synonyms: N- [(2Z)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- N'- [3- (trifluoromethyl)phenyl]butanediamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)Nc2cccc(c2)C(F)(F)F)/s1)C

STL041905
Synonyms: 4- {[(E)- (3- methoxyphenyl)methylidene]amino}- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: COc1cccc(c1)/C=N/n1c(S)nnc1c1n[nH]c(c1)c1ccccc1

STL041906
Synonyms: (2S)- N'- [(E)- quinoxalin- 5- ylmethylidene]pyrrolidine- 2- carbohydrazide(non- preferredname)
Smiles: O=C([C@@H]1CCCN1)N/N=C/c1cccc2c1nccn2

STL041907
Synonyms: methylN- (benzylcarbamoyl)- L- phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccccc1

STL041912
Synonyms: (6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methylthiophene- 2- carboxylate
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)COC(=O)c1cccs1

STL041913
Synonyms: N- [(2Z)- 5- (1H- indol- 3- ylmethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)/N=c\1/[nH]nc(s1)Cc1c[nH]c2c1cccc2

STL041920
Synonyms: 2,2,5- trimethyl- 4- (4- methylphenyl)- 2,5- dihydro- 1H- imidazol- 1- ol3- oxide
Smiles: Cc1ccc(cc1)C1=[N+]([O-])C(N(C1C)O)(C)C

STL041922
Synonyms: 2- [(E)- (5- cyano- 2,6- dihydroxy- 4- methylpyridin- 3- yl)diazenyl]benzoicacid
Smiles: N#Cc1c(O)nc(c(c1C)/N=N/c1ccccc1C(=O)O)O

STL041926
Synonyms: N- [(2E)- 5- [(3,5- dimethylphenoxy)methyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2,2- dimethylpropanamide
Smiles: Cc1cc(OCc2n[nH]/c(=N\C(=O)C(C)(C)C)/s2)cc(c1)C

STL041932
Synonyms: (5E)- 1- (2- chlorophenyl)- 5- ({[3- (morpholin- 4- ium- 4- yl)propyl]amino}methylidene)- 2,6- dioxo- 1,2,5,6- tetrahydropyrimidin- 4- olate
Smiles: O=C1N=C([O-])/C(=C\NCCC[NH+]2CCOCC2)/C(=O)N1c1ccccc1Cl

STL041935
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 2- (3- nitrophenyl)- 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(C1c1cccc(c1)[N+](=O)[O-])CCCn1c[nH+]cc1)/[O-]

STL041943
Synonyms: N- [(4E)- [1]benzofuro[3,2- d]pyrimidin- 4(3H)- ylidene]- 3- chloroaniline
Smiles: Clc1cccc(c1)/N=c\1/[nH]cnc2c1oc1c2cccc1

STL041954
Synonyms: (6E)- 4- (1- benzofuran- 2- yl)- 6- [(4- methoxyphenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: COc1ccc(cc1)/N=c/1\[nH]c(N)nc(n1)c1cc2c(o1)cccc2

STL041956
Synonyms: 6- hydroxy- 1,3- dimethyl- 5- {(1E)- N- [4- (propan- 2- yl)phenyl]propanimidoyl}pyrimidine- 2,4(1H,3H)- dione
Smiles: CC/C(=N\c1ccc(cc1)C(C)C)/c1c(O)n(C)c(=O)n(c1=O)C

STL041959
Synonyms: N- [(3Z)- 1- ethyl- 7- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]propanamide
Smiles: CCC(=O)/N=c/1\[nH]n(c2c1cc1ccc(cc1n2)C)CC

STL041960
Synonyms: 8- (dimethylamino)- 6- hydroxy- 3- methyl- 7- (2- phenoxyethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN(c1nc2c(n1CCOc1ccccc1)c(O)nc(=O)n2C)C

STL041963
Synonyms: 4- [4- (5- chloro- 2- methoxybenzyl)piperazin- 1- yl]- 4- oxo- N- [(2Z)- 5- propyl- 1,3,4- thiadiazol- 2(3H)- ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)Cc2cc(Cl)ccc2OC)/s1

STL041967
Synonyms: 4- (8- hydroxy- 3,3,6,6- tetramethyl- 1- oxo- 1,2,3,4,5,6,7,9- octahydroacridin- 9- yl)benzonitrile
Smiles: N#Cc1ccc(cc1)C1C2=C(O)CC(CC2=NC2=C1C(=O)CC(C2)(C)C)(C)C

STL041985
Synonyms: 1,1'- binaphthalene- 4,4'- diylbis[(1,1- dioxidotetrahydrothiophen- 3- yl)carbamate]
Smiles: O=C(Oc1ccc(c2c1cccc2)c1ccc(c2c1cccc2)OC(=O)NC1CCS(=O)(=O)C1)NC1CCS(=O)(=O)C1

STL041990
Synonyms: N- [(2Z)- 3- [(2- ethoxyphenyl)amino]quinoxalin- 2(1H)- ylidene]- 3- methylbenzenesulfonamide
Smiles: CCOc1ccccc1Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)C

STL041993
Synonyms: 3- ({(1Z)- 1- [4- hydroxy- 2,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}amino)benzoicacid
Smiles: C=CCN1C(=O)N=C(/C(=C(/Nc2cccc(c2)C(=O)O)\C)/C1=O)O

STL041998
Synonyms: 6- (1,3- benzodioxol- 5- yl)- 3- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine
Smiles: C1Oc2c(O1)ccc(c2)C1=Nn2c(SC1)nnc2c1[nH]nc2c1CCC2

STL042002
Synonyms: ethyl7- chloro- 6- (furan- 2- yl)- 4- hydroxyquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1O)cc(c(c2)Cl)c1ccco1

STL042010
Synonyms: 2- [5- (benzylsulfanyl)- 1,3,4- oxadiazol- 2- yl]ethanamine
Smiles: NCCc1nnc(o1)SCc1ccccc1

STL042011
Synonyms: 6'- amino- 1- methyl- 3'- {[(4- methylphenyl)sulfanyl]methyl}- 2- oxo- 1,2- dihydro- 2'H- spiro[indole- 3,4'- pyrano[2,3- c]pyrazole]- 5'- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)C)c(CSc1ccc(cc1)C)[nH]n2

STL042015
Synonyms: 4- {(3E)- 3- [hydroxy(phenyl)methylidene]- 4,5- dioxo- 2- phenylpyrrolidin- 1- yl}benzenesulfonamide
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1)c1ccc(cc1)S(=O)(=O)N)/c1ccccc1

STL042016
Synonyms: N- [2- methyl- 5- (6- methyl[1,2,4]triazolo[3,4- a]phthalazin- 3- yl)phenyl]acetamide
Smiles: CC(=O)Nc1cc(ccc1C)c1nnc2n1nc(C)c1c2cccc1

STL042023
Synonyms: 4- [4- (4,6- dimethylpyrimidin- 2- yl)piperazin- 1- yl]- 2- ethyl[1]benzofuro[3,2- d]pyrimidine
Smiles: CCc1nc(N2CCN(CC2)c2nc(C)cc(n2)C)c2c(n1)c1ccccc1o2

STL042025
Synonyms: (5E)- 1- (butan- 2- yl)- 5- [(2,3- dihydro- 1H- inden- 5- ylamino)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCC(N1C(=NC(=O)/C(=C\Nc2ccc3c(c2)CCC3)/C1=O)S)C

STL042027
Synonyms: (E)- {2- (4- hydroxyphenyl)- 1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 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(cc1)O)CCCn1c[nH+]cc1)/[O-]

STL042040
Synonyms: 4- ({(1E)- 1- [4- hydroxy- 2,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}amino)benzoicacid
Smiles: C=CCN1C(=O)N=C(/C(=C(\Nc2ccc(cc2)C(=O)O)/C)/C1=O)O

STL042063
Synonyms: N- [(2Z)- 3- [(2- chlorobenzyl)amino]quinoxalin- 2(1H)- ylidene]- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCc1ccccc1Cl

STL042068
Synonyms: 5- amino- 1- cyclopropyl- 7- (3,5- dimethylpiperazin- 4- ium- 1- yl)- 6,8- difluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CC1[NH2+]C(C)CN(C1)c1c(F)c(N)c2c(c1F)n(cc(c2=O)C(=O)[O-])C1CC1

STL042072
Synonyms: N- methyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 2- carboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)c1ccccn1)C

STL042073
Synonyms: (2E,5Z)- 5- (4- hydroxy- 3- methoxybenzylidene)- 2- (pyridin- 3- ylimino)- 1,3- thiazolidin- 4- one
Smiles: COc1cc(ccc1O)/C=C/1\S/C(=N/c2cccnc2)/NC1=O

STL042074
Synonyms: (2R)- 2- amino- N'- [(E)- 2H- chromen- 3- ylmethylidene]propanehydrazide(non- preferredname)
Smiles: O=C([C@H](N)C)N/N=C/C1=Cc2c(OC1)cccc2

STL042082
Synonyms: 4- (pyridin- 2- yl)- N- [3- (trifluoromethyl)phenyl]piperazine- 1- carboxamide
Smiles: O=C(N1CCN(CC1)c1ccccn1)Nc1cccc(c1)C(F)(F)F

STL042087
Synonyms: ethyl[(5Z)- 5- ({[(4- chlorophenyl)sulfanyl]acetyl}imino)- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]acetate
Smiles: CCOC(=O)Cc1n[nH]/c(=N/C(=O)CSc2ccc(cc2)Cl)/s1

STL042089
Synonyms: N- [(2S)- 1- {4- [(4- methoxyphenyl)sulfonyl]piperazin- 1- yl}- 3- methyl- 1- oxobutan- 2- yl]- 1- [(4- methylphenyl)sulfonyl]piperidine- 4- carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)[C@H](C(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STL042092
Synonyms: 1- {2- [4- (difluoromethoxy)phenyl]- 2- oxoethyl}- 3- phenyl- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: FC(Oc1ccc(cc1)C(=O)Cn1cc([n+]2c1CCC2)c1ccccc1)F

STL042093
Synonyms: methylN- [(3- chloro- 4- methoxyphenyl)carbamoyl]- D- methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1ccc(c(c1)Cl)OC

STL042094
Synonyms: 2- (2- chlorophenyl)- 12- phenyl- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 3- ium- 9- olate
Smiles: [O-]c1ccc2c(c1)Oc1c(C2c2ccccc2)c2nc([nH+]n2cn1)c1ccccc1Cl

STL042096
Synonyms: 2- (carboxymethyl)- 2- formylbutanedioate
Smiles: O=CC(C(=O)[O-])(CC(=O)O)CC(=O)[O-]

STL042112
Synonyms: N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (propan- 2- yl)benzamide
Smiles: CC(N(C(=O)c1ccccc1)Cc1cc2cccc(c2[nH]c1=O)C)C

STL042116
Synonyms: N- (5- oxo- 7- phenyl- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)- 2- phenoxyacetamide
Smiles: O=C(Nc1[nH]c2=NC(=O)CC(n2n1)c1ccccc1)COc1ccccc1

STL042117
Synonyms:
Smiles: CCCCOC(=O)c1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc2c1nsn2

STL042153
Synonyms: N,N- diethyl- 4- [3- (5- phenyl- 1H- pyrazol- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]aniline
Smiles: CCN(c1ccc(cc1)c1nn2c(s1)nnc2c1n[nH]c(c1)c1ccccc1)CC

STL042156
Synonyms: 3- [(3E)- 3- [hydroxy(4- methylphenyl)methylidene]- 2- (4- methoxyphenyl)- 4,5- dioxopyrrolidin- 1- yl]benzoicacid
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1cccc(c1)C(=O)O

STL042173
Synonyms:
Smiles: CCC([C@@H](C(=O)OC)NC(=O)Nc1ccc2c(c1)OCCO2)C

STL042182
Synonyms: (6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methylcyclohexanecarboxylate
Smiles: O=C(C1CCCCC1)OCc1cc2cc(C)ccc2[nH]c1=O

STL042185
Synonyms: 3- (5- chloro- 2- methoxyphenyl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- imine5,5- dioxide
Smiles: COc1ccc(cc1N1C(=N)SC2C1CS(=O)(=O)C2)Cl

STL042188
Synonyms: N- cyclopentyl- 2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: CCc1nc(NC2CCCC2)c2c(n1)c1ccccc1o2

STL042205
Synonyms: 6- hydroxy- 8- [4- (2- hydroxyethyl)piperazin- 1- yl]- 3- methyl- 7- (2- oxo- 2- phenylethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCN1CCN(CC1)c1nc2c(n1CC(=O)c1ccccc1)c(O)nc(=O)n2C

STL042209
Synonyms: (2Z)- 2- [(4,6- dimethylpyrimidin- 2- yl)imino]- 6- hydroxy- 3- (3- methylphenyl)- 2,3,4,5- tetrahydropyrimidine- 4- carboxylicacid
Smiles: OC1=N/C(=N\c2nc(C)cc(n2)C)/N(C(C1)C(=O)O)c1cccc(c1)C

STL042214
Synonyms: 7- chloro- N- ethyl- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: CCNc1cc(Cl)c2c(c1[N+](=O)[O-])non2

STL042224
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (5- methoxy- 2- methyl- 4- nitrophenyl)- 5,7- dimethyl- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: COc1cc(c(cc1[N+](=O)[O-])C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(C)cc2C

STL042226
Synonyms: N- [(2Z)- 3- [(furan- 2- ylmethyl)amino]quinoxalin- 2(1H)- ylidene]- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCc1ccco1

STL042246
Synonyms: 8- ethoxy- 4- [4- (4- nitrophenyl)piperazin- 1- yl]- 5H- pyrimido[5,4- b]indole
Smiles: CCOc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STL042247
Synonyms: 3- [5- (3,4- dimethoxyphenyl)- 1,2,4- oxadiazol- 3- yl]quinolin- 2(1H)- one
Smiles: COc1cc(ccc1OC)c1onc(n1)c1cc2ccccc2[nH]c1=O

STL042249
Synonyms: 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4- ({(E)- [4- (trifluoromethyl)phenyl]methylidene}amino)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1/N=C/c1ccc(cc1)C(F)(F)F)c1n[nH]c(c1)c1ccccc1

STL042251
Synonyms: (6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methylpyridine- 2- carboxylate
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)COC(=O)c1ccccn1

STL042253
Synonyms: ethyl{(5E)- 5- [(tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)imino]- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl}acetate
Smiles: CCOC(=O)Cc1n[nH]/c(=N\C(=O)C23CC4CC(C3)CC(C2)C4)/s1

STL042261
Synonyms: 7- methyl- 4- (morpholin- 4- ium- 4- ylmethyl)- 2- oxo- 2H- chromen- 6- olate
Smiles: O=c1cc(C[NH+]2CCOCC2)c2c(o1)cc(c(c2)[O-])C

STL042276
Synonyms: 2- {5- [(E)- {2- [(4- amino- 1,2,5- oxadiazol- 3- yl)carbonyl]hydrazinylidene}methyl]furan- 2- yl}- 5- bromobenzoicacid
Smiles: Brc1ccc(c(c1)C(=O)O)c1ccc(o1)/C=N/NC(=O)c1nonc1N

STL042279
Synonyms: (E)- [4,5- dioxo- 2- phenyl- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene][4- (2- methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)Cc1ccc[nH+]c1)/[O-])C

STL042290
Synonyms: 7,8- dimethoxy- 3- (2- methylpropyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncn(c1=O)CC(C)C

STL042298
Synonyms: 1- (2- imino- 3- pentyl- 2,3- dihydro- 1H- benzimidazol- 1- yl)- 3- (3- methylphenoxy)propan- 2- ol
Smiles: CCCCCn1c(=N)n(c2c1cccc2)CC(COc1cccc(c1)C)O

STL042303
Synonyms: 3- chloro- N- (3- nitro- 5- phenoxyphenyl)- 5- phenyl- 7- (trifluoromethyl)- 4,5,6,7- tetrahydropyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(c1Cl)NC(CC2C(F)(F)F)c1ccccc1)Nc1cc(Oc2ccccc2)cc(c1)[N+](=O)[O-]

STL042307
Synonyms: 2- [(2- methoxyphenoxy)methyl]- 12- phenyl- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 3- ium- 9- olate
Smiles: COc1ccccc1OCc1[nH+]n2c(n1)c1c(nc2)Oc2c(C1c1ccccc1)ccc(c2)[O-]

STL042313
Synonyms: (5E)- 6- hydroxy- 5- (1- {[2- (1H- indol- 3- yl)ethyl]amino}propylidene)- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\NCCc2c[nH]c3c2cccc3)/CC)/C1=O)O

STL042317
Synonyms: N- benzyl- 9- (2,2- dimethoxyethyl)- 6- methyl- 2,3,4,9- tetrahydro- 1H- carbazol- 1- amine
Smiles: COC(Cn1c2C(CCCc2c2c1ccc(c2)C)NCc1ccccc1)OC

STL042319
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 2- (4- methoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methanolate
Smiles: COc1ccc(cc1)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/[O-]

STL042328
Synonyms: 1- (2- {[4- (methoxycarbonyl)phenyl]amino}- 2- oxoethyl)- 3- (4- methoxyphenyl)- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: COc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)Nc1ccc(cc1)C(=O)OC

STL042331
Synonyms: N- [(4- benzylpiperidin- 1- yl)carbonyl]phenylalanine
Smiles: OC(=O)C(NC(=O)N1CCC(CC1)Cc1ccccc1)Cc1ccccc1

STL042333
Synonyms: (5E)- 1- (4- methoxyphenyl)- 2,6- dioxo- 5- {1- [(pyridinium- 3- ylmethyl)amino]ethylidene}- 1,2,5,6- tetrahydropyrimidin- 4- olate
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCc2ccc[nH+]c2)/C)/C1=O)[O-]

STL042339
Synonyms: N- [2- (5- methoxy- 1- {2- [(4- methylpiperazin- 1- yl)methoxy]ethyl}- 1H- indol- 3- yl)ethyl]acetamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)C)cn2CCOCN1CCN(CC1)C

STL042340
Synonyms: 4- {[(E)- (5- methylfuran- 2- yl)methylidene]amino}- 5- (5- methyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Cc1[nH]nc(c1)c1nnc(n1/N=C/c1ccc(o1)C)S

STL042342
Synonyms: 4- methyl- 1- (octan- 2- yl)- 1H- pyrazolo[3,4- b]pyridine- 3,6- diol
Smiles: CCCCCCC(n1nc(c2c1nc(O)cc2C)O)C

STL042345
Synonyms: (5E)- 6- hydroxy- 3- phenyl- 5- {1- [(tetrahydrofuran- 2- ylmethyl)amino]propylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1)O)/NCC1CCCO1

STL042346
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 5- (pyrrolidin- 2- yl)- 1,3,4- oxadiazole
Smiles: Fc1cccc(c1)CSc1nnc(o1)C1CCCN1

STL042358
Synonyms: N- {7- [2- (3,4- dimethoxyphenyl)ethyl]- 4- hydroxy- 2,6- dioxo- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl}- 3- methylbutanamide
Smiles: COc1cc(CCN2c3[nH]c(=O)nc(c3C(C2=O)(NC(=O)CC(C)C)C(F)(F)F)O)ccc1OC

STL042375
Synonyms: N- [(2Z)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- {4- [2- (naphthalen- 1- yloxy)ethyl]piperazin- 1- yl}- 4- oxobutanamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C)CCC(=O)N1CCN(CC1)CCOc1cccc2c1cccc2

STL042376
Synonyms: 1',6'- dimethyl- 2,6- dioxo- 1- [3- (trifluoromethyl)phenyl]- 1,1',4',6- tetrahydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinolinium]- 4- olate
Smiles: Cc1ccc2c(c1)CC1(C[NH+]2C)C(=NC(=O)N(C1=O)c1cccc(c1)C(F)(F)F)[O-]

STL042388
Synonyms: 2,5- dichloro- N- [(2Z)- 3- [(tetrahydrofuran- 2- ylmethyl)amino]quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: Clc1ccc(c(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCC1CCCO1)Cl

STL042390
Synonyms: N- [(4- fluorobenzyl)carbamoyl]methionine
Smiles: CSCCC(C(=O)O)NC(=O)NCc1ccc(cc1)F

STL042393
Synonyms: N,2- diethyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: CCNc1nc(CC)nc2c1oc1c2cccc1

STL042403
Synonyms: 6- amino- 3- (3- methoxyphenyl)- 4- (2,3,4- trimethoxyphenyl)- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: COc1cccc(c1)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1ccc(c(c1OC)OC)OC

STL042417
Synonyms: 4- {[(E)- anthracen- 9- ylmethylidene]amino}- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1/N=C/c1c2ccccc2cc2c1cccc2)c1n[nH]c(c1)c1ccccc1

STL042422
Synonyms: (4E)- 4- [furan- 2- yl(hydroxy)methylidene]- 1- [2- (2- hydroxyethoxy)ethyl]- 5- (4- hydroxy- 3- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: OCCOCCN1C(c2ccc(c(c2)OC)O)/C(=C(/c2ccco2)\O)/C(=O)C1=O

STL042428
Synonyms: 2- {[5- (1- amino- 2- methylbutyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- N- (2,3- dimethylphenyl)acetamide
Smiles: CCC(C(c1nnc(o1)SCC(=O)Nc1cccc(c1C)C)N)C

STL042435
Synonyms: 3- (nitromethyl)tetrahydrothiophene1,1- dioxide
Smiles: [O-][N+](=O)CC1CCS(=O)(=O)C1

STL042448
Synonyms: 2- (2- methylphenyl)- 12- phenyl- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 3- ium- 9- olate
Smiles: [O-]c1ccc2c(c1)Oc1c(C2c2ccccc2)c2nc([nH+]n2cn1)c1ccccc1C

STL042455
Synonyms: (5Z)- 5- {1- [(2- aminophenyl)amino]ethylidene}- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C(\Nc2ccccc2N)/C)/C(=N1)O

STL042460
Synonyms: (E)- {2- (3,4- dichlorophenyl)- 1- [2- (dimethylammonio)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}[4- (propan- 2- yloxy)phenyl]methanolate
Smiles: C[NH+](CCN1C(c2ccc(c(c2)Cl)Cl)/C(=C(/c2ccc(cc2)OC(C)C)\[O-])/C(=O)C1=O)C

STL042462
Synonyms: 2- {[4- amino- 5- (4- fluorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4,6- trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1N)c1ccc(cc1)F

STL042464
Synonyms: N'- {(E)- [1- (butan- 2- yl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}heptanehydrazide
Smiles: CCCCCCC(=O)NN/C=C/1\C(=O)N=C(N(C1=O)C(CC)C)S

STL042481
Synonyms: 2- {[5- (5- aminopentyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- N- (3- chlorophenyl)acetamide
Smiles: NCCCCCc1nnc(o1)SCC(=O)Nc1cccc(c1)Cl

STL042494
Synonyms: ethyl2- {[7- (4- fluorophenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}butanoate
Smiles: CCOC(=O)C(Sc1nnc2n1cnc1c2cnn1c1ccc(cc1)F)CC

STL042498
Synonyms: 4- ({[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STL042499
Synonyms: 3- chloro- N- [(4E)- 2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4(3H)- ylidene]- 4- methoxyaniline
Smiles: CCc1[nH]/c(=N/c2ccc(c(c2)Cl)OC)/c2c(n1)c1ccccc1o2

STL042501
Synonyms: 9a- [(E)- 2- (2- chlorophenyl)ethenyl]- 7,9,9- trimethyl- 9,9a- dihydro- 1H- imidazo[1,2- a]indol- 2(3H)- one
Smiles: O=C1CN2C(N1)(/C=C/c1ccccc1Cl)C(c1c2ccc(c1)C)(C)C

STL042507
Synonyms: 6- [(2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)amino]hexanoicacid
Smiles: CCc1nc(NCCCCCC(=O)O)c2c(n1)c1ccccc1o2

STL042512
Synonyms: 4- [(2Z)- 2- (2- amino- 6- hydroxy- 4- oxopyrimidin- 5(4H)- ylidene)hydrazinyl]benzoicacid
Smiles: NC1=NC(=O)/C(=N\Nc2ccc(cc2)C(=O)O)/C(=N1)O

STL042526
Synonyms: 2- [({(6Z)- 4- amino- 6- [(2- methoxyphenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- yl}methyl)sulfanyl]ethanol
Smiles: OCCSCc1nc(N)n/c(=N\c2ccccc2OC)/[nH]1

STL042535
Synonyms: (4Z)- 4- [(2- methoxyphenyl)imino]- 6- ({[5- (pyridin- 4- yl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}methyl)- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: COc1ccccc1/N=c\1/[nH]c(CSc2nnc(o2)c2ccncc2)nc(n1)N

STL042550
Synonyms: 3- (5- ethyl- 1,2,4- oxadiazol- 3- yl)quinolin- 2(1H)- one
Smiles: CCc1onc(n1)c1cc2ccccc2[nH]c1=O

STL042552
Synonyms: (5Z)- 5- (butan- 2- ylidene)- 2- [4- (4- nitrophenyl)piperazin- 1- yl]- 1,3- thiazol- 4(5H)- one
Smiles: CC/C(=C/1\SC(=NC1=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])/C

STL042584
Synonyms: 3- {(3E)- 2- (2- fluorophenyl)- 3- [hydroxy(phenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}propanoicacid
Smiles: OC(=O)CCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1F

STL042587
Synonyms: 2- chloro- 6- (2,6- dimethylmorpholin- 4- yl)- 5- nitropyrimidin- 4- amine
Smiles: CC1OC(C)CN(C1)c1nc(Cl)nc(c1[N+](=O)[O-])N

STL042593
Synonyms: (5E)- 5- {1- [(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)amino]ethylidene}- 2- hydroxy- 1- (prop- 2- en- 1- yl)pyrimidine- 4,6(1H,5H)- dione
Smiles: C=CCN1C(=NC(=O)/C(=C(\Nc2c(=O)n(n(c2C)C)c2ccccc2)/C)/C1=O)O

STL042607
Synonyms: (5E)- 1- benzyl- 2- hydroxy- 5- {1- [2- (naphthalen- 1- yl)hydrazinyl]ethylidene}pyrimidine- 4,6(1H,5H)- dione
Smiles: C/C(=C\1/C(=O)N=C(N(C1=O)Cc1ccccc1)O)/NNc1cccc2c1cccc2

STL042609
Synonyms: (5Z)- 2- hydroxy- 5- (1- {[2- (morpholin- 4- ium- 4- yl)ethyl]amino}ethylidene)- 6- oxo- 5,6- dihydropyrimidin- 4- olate
Smiles: OC1=NC(=O)/C(=C(\NCC[NH+]2CCOCC2)/C)/C(=N1)[O-]

STL042610
Synonyms: 4- [4- (diphenylmethyl)piperazin- 1- yl]- 4- oxo- N- [(2Z)- 5- propyl- 1,3,4- thiadiazol- 2(3H)- ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)C(c2ccccc2)c2ccccc2)/s1

STL042612
Synonyms: 5- (4- chlorophenyl)- 3- (3,4- dimethoxyphenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1cc(ccc1OC)C1=NOC2C1C(=O)N(C2=O)c1ccc(cc1)Cl

STL042618
Synonyms: 4- {4- [2- (4- methylphenoxy)ethyl]piperazin- 1- yl}- 4- oxo- N- [(2Z)- 5- propyl- 1,3,4- thiadiazol- 2(3H)- ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)CCOc2ccc(cc2)C)/s1

STL042621
Synonyms: (2E)- 3- [5- (2- bromo- 4- methylphenyl)furan- 2- yl]- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: Cc1ccc(c(c1)Br)c1ccc(o1)/C=C(\C(=O)[O-])/Sc1[nH]nc([nH+]1)C

STL042622
Synonyms: 3- [(E)- {(2Z)- [4- {3- [(2,6- dimethylmorpholin- 4- yl)sulfonyl]phenyl}- 1,3- thiazol- 2(3H)- ylidene]hydrazinylidene}methyl]phenol
Smiles: CC1OC(C)CN(C1)S(=O)(=O)c1cccc(c1)c1cs/c(=N\N=C\c2cccc(c2)O)/[nH]1

STL042626
Synonyms: 4- (4- ethoxyphenyl)- 3- (4- methoxyphenyl)- 5- [(4- nitrobenzyl)sulfanyl]- 4H- 1,2,4- triazole
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccc(cc1)OC

STL042630
Synonyms: 2- (2- {[4- amino- 6- (4- benzylpiperazin- 1- yl)- 5- nitropyrimidin- 2- yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1nc(N2CCN(CC2)Cc2ccccc2)c(c(n1)N)[N+](=O)[O-]

STL042636
Synonyms: methylN- (dicyclohexylcarbamoyl)methioninate
Smiles: COC(=O)C(NC(=O)N(C1CCCCC1)C1CCCCC1)CCSC

STL042639
Synonyms: 4- methoxy- N- [(2Z)- 3- [(3- methoxypropyl)amino]quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: COCCCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)OC

STL042653
Synonyms: N- (4- hydroxyquinazolin- 2- yl)- 2- (methylsulfanyl)benzamide
Smiles: CSc1ccccc1C(=O)Nc1nc(O)c2c(n1)cccc2

STL042656
Synonyms: N- (2,5- dimethoxyphenyl)- 2- [(4- hydroxy- 6- phenylpyrimidin- 2- yl)sulfanyl]acetamide
Smiles: COc1ccc(c(c1)NC(=O)CSc1nc(O)cc(n1)c1ccccc1)OC

STL042660
Synonyms: 2- methyl- 3- (5- methyl- 2- oxotetrahydrofuran- 3- yl)- N- [(2Z)- 1,3,4- thiadiazol- 2(3H)- ylidene]propanamide
Smiles: CC(C(=O)/N=c/1\scn[nH]1)CC1CC(OC1=O)C

STL042664
Synonyms: 1- (1H- indol- 3- yl)- 2- nitroethanesulfonicacid
Smiles: [O-][N+](=O)CC(S(=O)(=O)O)c1c[nH]c2c1cccc2

STL042665
Synonyms: 3- benzyl- 1- (1- ethenyl- 1H- benzimidazol- 2- yl)pyrrolidine- 2,5- dione
Smiles: C=Cn1c(nc2c1cccc2)N1C(=O)CC(C1=O)Cc1ccccc1

STL042666
Synonyms: 3- (3,4- dichlorophenyl)- 1- {2- [(2,4- dimethoxyphenyl)amino]- 2- oxoethyl}- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: COc1ccc(c(c1)OC)NC(=O)Cn1cc([n+]2c1CCC2)c1ccc(c(c1)Cl)Cl

STL042669
Synonyms: 4- (4- chlorophenyl)- 1- cyclohexyl- 4,6- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7- ol
Smiles: OC1=Nc2c(C(SC1)c1ccc(cc1)Cl)cnn2C1CCCCC1

STL042702
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (pyridin- 3- yl)pyrrolidin- 3- ylidene](4- propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)Cc1ccc[nH+]c1)/[O-]

STL042704
Synonyms: (4E)- 4- hydrazinylidene- 4,5,6,7- tetrahydro- 2,1,3- benzoxadiazole
Smiles: N/N=C/1\CCCc2c1non2

STL042705
Synonyms: 4- {[3- (1H- benzotriazol- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]amino}phenyl2- nitrobenzoate
Smiles: O=C1c2ccccc2C(=O)C(=C1Nc1ccc(cc1)OC(=O)c1ccccc1[N+](=O)[O-])n1nnc2c1cccc2

STL042717
Synonyms: 1- [1- (4- methoxyphenyl)- 1- oxopropan- 2- yl]- 3- phenyl- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: COc1ccc(cc1)C(=O)C(n1cc([n+]2c1CCC2)c1ccccc1)C

STL042720
Synonyms: N- [(2E)- 5- (3,4- dimethoxyphenyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- methylbutanamide
Smiles: COc1cc(ccc1OC)c1n[nH]/c(=N\C(=O)CC(C)C)/s1

STL042728
Synonyms: N- cyclohexyl- 2- [5- (4- nitrophenyl)- 1H- imidazol- 1- yl]acetamide
Smiles: O=C(Cn1cncc1c1ccc(cc1)[N+](=O)[O-])NC1CCCCC1

STL042733
Synonyms: 5- [(1E)- N- (4- ethoxyphenyl)ethanimidoyl]- 6- hydroxy- 1,3- dimethylpyrimidine- 2,4(1H,3H)- dione
Smiles: CCOc1ccc(cc1)/N=C(/c1c(O)n(C)c(=O)n(c1=O)C)\C

STL042744
Synonyms: 2- [(4,7- dimethylquinazolin- 2- yl)amino]- 6- propylpyrimidin- 4- ol
Smiles: CCCc1nc(nc(c1)O)Nc1nc(C)c2c(n1)cc(cc2)C

STL042767
Synonyms: 2- [(E)- (1H- 3,1- benzimidazol- 3- ium- 1- ylimino)methyl]- 4- nitrophenolate
Smiles: [O-]c1ccc(cc1/C=N/n1c[nH+]c2c1cccc2)[N+](=O)[O-]

STL042771
Synonyms: 4- hydroxy- 1,7- dimethyl- 9- phenyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purin- 2(1H)- one
Smiles: CC1CN(c2ccccc2)c2n(C1)c1c(O)nc(=O)n(c1n2)C

STL042794
Synonyms: 1,1'- benzene- 1,2- diylbis{3- chloro- 4- [(4- ethylphenyl)amino]- 1H- pyrrole- 2,5- dione}
Smiles: CCc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)c1ccccc1N1C(=O)C(=C(C1=O)Nc1ccc(cc1)CC)Cl

STL042797
Synonyms: N- (4- {[(1Z)- 1- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)ethyl]amino}phenyl)acetamide
Smiles: OC1=NC(=O)/C(=C(\Nc2ccc(cc2)NC(=O)C)/C)/C(=N1)O

STL042798
Synonyms: (5Z)- 1- (2- methoxyphenyl)- 4,6- dioxo- 5- {[2- (1,3,7- trimethyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 9- ium- 8- yl)hydrazinyl]methylidene}- 1,4,5,6- tetrahydropyrimidine- 2- thiolate
Smiles: COc1ccccc1N1C(=NC(=O)/C(=C/NNc2[nH+]c3c(n2C)c(=O)n(c(=O)n3C)C)/C1=O)[S-]

STL042805
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- nitrophenyl)- N'- [(E)- (3,4,5- trimethoxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)[N+](=O)[O-])c2nonc2N)cc(c1OC)OC

STL042809
Synonyms: 3- {(3E)- 2- (4- fluorophenyl)- 3- [(2E)- 1- hydroxy- 3- phenylprop- 2- en- 1- ylidene]- 4,5- dioxopyrrolidin- 1- yl}benzoicacid
Smiles: Fc1ccc(cc1)C1N(c2cccc(c2)C(=O)O)C(=O)C(=O)/C/1=C(\C=C\c1ccccc1)/O

STL042811
Synonyms: 6- amino- 3- (4- ethoxy- 3- methoxyphenyl)- 4- (5- methylthiophen- 2- yl)- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: CCOc1ccc(cc1OC)c1[nH]nc2c1C(c1ccc(s1)C)C(=C(O2)N)C#N

STL042835
Synonyms: 4- {[(E)- (2- chloro- 5- nitrophenyl)methylidene]amino}- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1/N=C/c1cc(ccc1Cl)[N+](=O)[O-])c1n[nH]c(c1)c1ccccc1

STL042836
Synonyms: 4- {4- [(5- chloro- 2- methoxyphenyl)sulfonyl]piperazin- 1- yl}- N- [(2Z)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxobutanamide
Smiles: CCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)c2cc(Cl)ccc2OC)/s1

STL042851
Synonyms: 3- methyl- N- [(2Z)- 3- {[4- (trifluoromethoxy)phenyl]amino}quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: Cc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(cc1)OC(F)(F)F

STL042861
Synonyms: 4- [(4E)- [1]benzofuro[3,2- d]pyrimidin- 4(3H)- ylideneamino]phenol
Smiles: Oc1ccc(cc1)/N=c\1/[nH]cnc2c1oc1c2cccc1

STL042895
Synonyms: N- {[2- (2- fluorophenyl)ethyl]carbamoyl}isoleucine
Smiles: CCC(C(C(=O)O)NC(=O)NCCc1ccccc1F)C

STL042898
Synonyms: 6- amino- 4- benzyl- 3- tert- butyl- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1Cc1ccccc1)c([nH]n2)C(C)(C)C

STL042921
Synonyms: 2- {[(2Z)- 4- hydroxy- 2H- 1,3- benzothiazin- 2- ylidene]amino}- 2- oxoethyl4- methylpiperazine- 1- carbodithioate
Smiles: CN1CCN(CC1)C(=S)SCC(=O)/N=c\1/nc(O)c2c(s1)cccc2

STL042922
Synonyms: 3- [(2Z)- 2- (2- amino- 6- hydroxy- 4- oxopyrimidin- 5(4H)- ylidene)hydrazinyl]benzoicacid
Smiles: NC1=NC(=O)/C(=N\Nc2cccc(c2)C(=O)O)/C(=N1)O

STL042933
Synonyms: 1- [2- (3- methoxyphenyl)- 2- oxoethyl]- 3- (4- methylphenyl)- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: COc1cccc(c1)C(=O)Cn1cc([n+]2c1CCC2)c1ccc(cc1)C

STL042946
Synonyms: 1- [2- (3,4- dimethoxyphenyl)- 2- oxoethyl]- 3- (4- methoxyphenyl)- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: COc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)c1ccc(c(c1)OC)OC

STL042954
Synonyms: N- cyclohexyl- N'- [(2E)- 5- (propan- 2- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]butanediamide
Smiles: CC(c1n[nH]/c(=N\C(=O)CCC(=O)NC2CCCCC2)/s1)C

STL042964
Synonyms: 6- (methoxymethyl)- 2- (4- phenylpiperazin- 1- yl)pyrimidin- 4- ol
Smiles: COCc1cc(O)nc(n1)N1CCN(CC1)c1ccccc1

STL042971
Synonyms: 3'- (2,4- dimethoxyphenyl)- 4'- (furan- 2- ylcarbonyl)- 4'H- spiro[indole- 3,5'- [1,2]oxazol]- 2(1H)- one
Smiles: COc1ccc(c(c1)OC)C1=NOC2(C1C(=O)c1ccco1)C(=O)Nc1c2cccc1

STL042972
Synonyms: (2Z)- 2- (7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 5(6H)- ylidene)- N- (2- phenylethyl)ethanethioamide
Smiles: S=C(/C=C/1\NCCc2c1cc1OCOc1c2)NCCc1ccccc1

STL042978
Synonyms: 2- {[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(Nc1nccs1)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STL042979
Synonyms: (2E)- N- [3- (1H- tetrazol- 1- yl)phenyl]- 3- (thiophen- 2- yl)prop- 2- enamide
Smiles: O=C(Nc1cccc(c1)n1cnnn1)/C=C/c1cccs1

STL042981
Synonyms: N- {[4- ({[(2,4- dioxo- 1,4- dihydroquinazolin- 3(2H)- yl)acetyl]amino}methyl)cyclohexyl]carbonyl}alanine
Smiles: O=C(Cn1c(=O)[nH]c2c(c1=O)cccc2)NCC1CCC(CC1)C(=O)NC(C(=O)O)C

STL042984
Synonyms: 5- [2- hydroxy- 9- methoxy- 4- oxo- 3- (propan- 2- yl)- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 5- yl]- 2,6- dioxo- 3- (propan- 2- yl)- 1,2,3,6- tetrahydropyrimidin- 4- olate
Smiles: COc1cccc2c1Oc1nc(O)n(c(=O)c1C2c1c(=O)[nH]c(=O)n(c1[O-])C(C)C)C(C)C

STL042985
Synonyms: 2- amino- 3- [(5,8- dimethoxy- 2- methylquinolin- 4- yl)sulfanyl]propanoate
Smiles: COc1ccc(c2c1c(SCC(C(=O)[O-])N)cc(n2)C)OC

STL042991
Synonyms: 3- phenyl- 3,4- dihydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: OC1=C2C=Nc3c(N=C2CC(C1)c1ccccc1)cccc3

STL042994
Synonyms: {2- [2- oxo- 4'- (phenylcarbonyl)- 1,2- dihydro- 4'H- spiro[indole- 3,5'- [1,2]oxazol]- 3'- yl]phenoxy}acetonitrile
Smiles: N#CCOc1ccccc1C1=NOC2(C1C(=O)c1ccccc1)C(=O)Nc1c2cccc1

STL042998
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4- difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STL042999
Synonyms: (3,4- dimethoxyphenyl)(oxo)acetate
Smiles: COc1cc(ccc1OC)C(=O)C(=O)[O-]

STL043006
Synonyms: 3- methyl- N- [3- oxo- 2- (trifluoromethyl)- 2,3- dihydro- 1H- imidazo[1,2- a]benzimidazol- 2- yl]butanamide
Smiles: CC(CC(=O)NC1(Nc2n(C1=O)c1c(n2)cccc1)C(F)(F)F)C

STL043007
Synonyms: 2'- hydroxy- 3- methyl- 8- nitro- 1'- [3- (trifluoromethyl)phenyl]- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)O

STL043009
Synonyms: 4- ({[(2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)acetyl]amino}methyl)cyclohexanecarboxylicacid
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)NCC1CCC(CC1)C(=O)O

STL043010
Synonyms: 11,13,13- trimethyl- 10,11- dihydro- 8,11- methanopyrido[3,2- a]phenazine- 8(9H)- carboxylate
Smiles: [O-]C(=O)C12CCC(C2(C)C)(c2c1nc1ccc3c(c1n2)cccn3)C

STL043013
Synonyms: 1'- methyl- 4'- (3- nitrophenyl)- 3'- (pyridin- 3- ylcarbonyl)spiro[indole- 3,2'- pyrrolidin]- 2(1H)- one
Smiles: O=C(C1C(CN(C21C(=O)Nc1c2cccc1)C)c1cccc(c1)[N+](=O)[O-])c1cccnc1

STL043017
Synonyms: (5R)- 5- benzyl- 3- {[4- (4- methoxyphenyl)tetrahydro- 2H- pyran- 4- yl]methyl}imidazolidine- 2,4- dione
Smiles: COc1ccc(cc1)C1(CCOCC1)CN1C(=O)N[C@@H](C1=O)Cc1ccccc1

STL043022
Synonyms: 2- {[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (5- chloropyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccc(cn1)Cl)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STL043027
Synonyms: 5- fluoro- 3''- (furan- 2- ylmethyl)- 1,1'- dimethyl- 4'- (pyridin- 2- yl)- 2''- thioxo- 4''H- dispiro[indole- 3,2'- pyrrolidine- 3',5''- [1,3]thiazolidine]- 2,4''(1H)- dione
Smiles: Fc1ccc2c(c1)C1(N(C)CC(C31SC(=S)N(C3=O)Cc1ccco1)c1ccccn1)C(=O)N2C

STL043028
Synonyms: 5- hydroxy- 3- (2- methoxybenzyl)- 2- phenyl- 5- (trifluoromethyl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1ccccc1CN1C(=NC(C1=O)(O)C(F)(F)F)c1ccccc1

STL043037
Synonyms: 6'- (1,3- benzodioxol- 5- ylcarbonyl)- 5- methyl- 7'- phenyl- 1',6',7',7a'- tetrahydrospiro[indole- 3,5'- pyrrolo[1,2- c][1,3]thiazol]- 2(1H)- one
Smiles: Cc1ccc2c(c1)C1(C(=O)N2)N2CSCC2C(C1C(=O)c1ccc2c(c1)OCO2)c1ccccc1

STL043038
Synonyms: 5- fluoro- 7'- (4- nitrophenyl)- 6'- (phenylcarbonyl)- 1',6',7',7a'- tetrahydrospiro[indole- 3,5'- pyrrolo[1,2- c][1,3]thiazol]- 2(1H)- one
Smiles: Fc1ccc2c(c1)C1(C(=O)N2)N2CSCC2C(C1C(=O)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STL043047
Synonyms: morpholin- 4- yl(1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)methanone
Smiles: O=C(N1CC2(CC1CC(C2)(C)C)C)N1CCOCC1

STL043050
Synonyms: 2- cyclopentyl- N- [2- (4- methoxyphenyl)ethyl]- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)C1C2C=CC3(C1C(=O)N(C3)C1CCCC1)O2

STL043056
Synonyms: N- (3,4- dichlorobenzyl)- 3- (5- oxoprolyl)- 1,3- thiazolidine- 4- carboxamide
Smiles: O=C1CCC(N1)C(=O)N1CSCC1C(=O)NCc1ccc(c(c1)Cl)Cl

STL043057
Synonyms: N- {[6- chloro- 8- (trifluoromethyl)[1,2,4]triazolo[4,3- a]pyridin- 3- yl]methyl}furan- 2- carboxamide
Smiles: Clc1cc(c2n(c1)c(CNC(=O)c1ccco1)nn2)C(F)(F)F

STL043061
Synonyms: N- (furan- 2- ylmethyl)- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxamide
Smiles: O=C(C1C2C=CC3(C1C(=O)N(C3)c1noc(c1)C)O2)NCc1ccco1

STL043066
Synonyms: (4- propoxybenzene- 1,3- diyl)bis(N,N,N- trimethylmethanaminium)
Smiles: CCCOc1ccc(cc1C[N+](C)(C)C)C[N+](C)(C)C

STL043068
Synonyms: 3- (5- oxoprolyl)- N- [4- (propan- 2- yl)phenyl]- 1,3- thiazolidine- 4- carboxamide
Smiles: CC(c1ccc(cc1)NC(=O)C1CSCN1C(=O)C1CCC(=O)N1)C

STL043069
Synonyms: N- cyclohexyl- N- methyl- 3- (5- oxoprolyl)- 1,3- thiazolidine- 4- carboxamide
Smiles: O=C1CCC(N1)C(=O)N1CSCC1C(=O)N(C1CCCCC1)C

STL043071
Synonyms: N- cyclopentyl- 2- (5- methoxy- 1,3- benzothiazol- 2- yl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxamide
Smiles: COc1ccc2c(c1)nc(s2)N1CC23C(C1=O)C(C(O3)C=C2)C(=O)NC1CCCC1

STL043076
Synonyms: 2- [(E)- 2- (5- chloro- 1H- indol- 3- yl)ethenyl]- 1,6- dimethylpyridinium
Smiles: Clc1ccc2c(c1)c(c[nH]2)/C=C/c1cccc([n+]1C)C

STL043087
Synonyms: methyl1- {[1- (4- fluorophenyl)- 9H- beta- carbolin- 3- yl]carbonyl}prolinate
Smiles: COC(=O)C1CCCN1C(=O)c1nc(c2ccc(cc2)F)c2c(c1)c1ccccc1[nH]2

STL043091
Synonyms: 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine- 2,4- diol
Smiles: Oc1nc(O)c2c(n1)sc1c2CCCC1

STL043096
Synonyms: 3'- (2,3- dimethoxyphenyl)- 4'- (furan- 2- ylcarbonyl)- 4'H- spiro[indole- 3,5'- [1,2]oxazol]- 2(1H)- one
Smiles: COc1cccc(c1OC)C1=NOC2(C1C(=O)c1ccco1)C(=O)Nc1c2cccc1

STL043101
Synonyms: 3- {[2- (4- methoxyphenyl)ethyl]amino}- 6- methyl- 1,2,4- triazin- 5- ol
Smiles: COc1ccc(cc1)CCNc1nnc(c(n1)O)C

STL043102
Synonyms: 2'- (furan- 2- ylcarbonyl)- 1'- (3- nitrophenyl)- 1',2',5',6',7',7a'- hexahydrospiro[indole- 3,3'- pyrrolizin]- 2(1H)- one
Smiles: O=C(C1C(c2cccc(c2)[N+](=O)[O-])C2N(C31C(=O)Nc1c3cccc1)CCC2)c1ccco1

STL043104
Synonyms: 1'- (4- chlorophenyl)- 2'- (pyridin- 2- ylcarbonyl)- 1',2',5',6',7',7a'- hexahydrospiro[indole- 3,3'- pyrrolizin]- 2(1H)- one
Smiles: Clc1ccc(cc1)C1C2CCCN2C2(C1C(=O)c1ccccn1)C(=O)Nc1c2cccc1

STL043105
Synonyms: 4'- (furan- 2- ylcarbonyl)- 3'- (4- methoxyphenyl)- 4'H- spiro[indole- 3,5'- [1,2]oxazol]- 2(1H)- one
Smiles: COc1ccc(cc1)C1=NOC2(C1C(=O)c1ccco1)C(=O)Nc1c2cccc1

STL043106
Synonyms: 3''- benzyl- 5- methoxy- 1,1'- dimethyl- 4'- (pyridin- 3- yl)- 2''- thioxo- 4''H- dispiro[indole- 3,2'- pyrrolidine- 3',5''- [1,3]thiazolidine]- 2,4''(1H)- dione
Smiles: COc1ccc2c(c1)C1(N(C)CC(C31SC(=S)N(C3=O)Cc1ccccc1)c1cccnc1)C(=O)N2C

STL043107
Synonyms: 4,7,7- trimethyl- 2,3- dioxo- N- {4- [(E)- phenyldiazenyl]phenyl}bicyclo[2.2.1]heptane- 1- carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1ccc(cc1)/N=N/c1ccccc1

STL043112
Synonyms: 4,7,7- trimethyl- 2,3- dioxo- N'- phenylbicyclo[2.2.1]heptane- 1- carbohydrazide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)NNc1ccccc1

STL043117
Synonyms: 5- (2,4- dichlorobenzyl)- 6- hydroxy- 3- (2- methylphenyl)- 2- oxo- 2,3- dihydropyrimidin- 4- olate
Smiles: Clc1ccc(c(c1)Cl)Cc1c(O)nc(=O)n(c1[O-])c1ccccc1C

STL043118
Synonyms: 4- [5- (5- methyl- 1H- pyrazol- 3- yl)- 1,2,4- oxadiazol- 3- yl]pyridine
Smiles: Cc1[nH]nc(c1)c1onc(n1)c1ccncc1

STL043122
Synonyms: 7- [2- hydroxy- 3- (pyridin- 4- ylamino)propoxy]- 4,8- dimethyl- 2H- chromen- 2- one
Smiles: OC(COc1ccc2c(c1C)oc(=O)cc2C)CNc1ccncc1

STL043126
Synonyms: 2- [5- (5- cyclopropyl- 1H- pyrazol- 3- yl)- 1,2,4- oxadiazol- 3- yl]pyridine
Smiles: c1ccc(nc1)c1noc(n1)c1n[nH]c(c1)C1CC1

STL043127
Synonyms: 7- {2- hydroxy- 3- [4- (pyridin- 2- yl)piperazin- 1- yl]propoxy}- 4,8- dimethyl- 2H- chromen- 2- one
Smiles: OC(CN1CCN(CC1)c1ccccn1)COc1ccc2c(c1C)oc(=O)cc2C

STL043129
Synonyms: 2- (4- fluorophenyl)- 4- methyl- 3- oxo- 5- (pyridin- 4- ylmethyl)- 3,5- dihydro- 2H- pyrazolo[4,3- c]pyridin- 6- olate
Smiles: Fc1ccc(cc1)n1nc2c(c1=O)c(C)n(c(c2)[O-])Cc1ccncc1

STL043133
Synonyms: 6- [2- (3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)ethyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Cc1nn(c(c1CCc1sc2n(n1)cnn2)C)c1ccccc1

STL043135
Synonyms: 3- [5- (5- phenyl- 1H- pyrazol- 3- yl)- 1,2,4- oxadiazol- 3- yl]pyridine
Smiles: c1ccc(cc1)c1[nH]nc(c1)c1onc(n1)c1cccnc1

STL043136
Synonyms: ethyl[2,6- dinitro- 4- (trifluoromethyl)phenyl]phosphonate
Smiles: CCOP(=O)(c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])[O-]

STL043142
Synonyms: 1,5- dicyano- 4- hydroxy- 9- methyl- 3- azaspiro[5.5]undeca- 1,3- diene- 2- thiolate
Smiles: N#CC1C(=NC(=C(C21CCC(CC2)C)C#N)[S-])O

STL043145
Synonyms: butyl6- (3- fluorophenyl)- 2- hydroxy- 4- methyl- 1,6- dihydropyrimidine- 5- carboxylate
Smiles: CCCCOC(=O)C1=C(C)N=C(NC1c1cccc(c1)F)O

STL043146
Synonyms: (2E)- 4- ({3- [carboxy(1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)methyl]- 1H- indol- 5- yl}amino)- 4- oxobut- 2- enoicacid
Smiles: OC(=O)/C=C/C(=O)Nc1ccc2c(c1)c(c[nH]2)C(N1CC2(CC1CC(C2)(C)C)C)C(=O)O

STL043150
Synonyms: 6- hydroxy- 3- methyl- 8- (morpholin- 4- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1[nH]c(n2)N1CCOCC1)C

STL043152
Synonyms: N- (4- fluorophenyl)- 2'- (2- methoxyethyl)- 1'- oxo- 1',4'- dihydro- 2'H- spiro[cyclopentane- 1,3'- isoquinoline]- 4'- carboxamide
Smiles: COCCN1C(=O)c2ccccc2C(C21CCCC2)C(=O)Nc1ccc(cc1)F

STL043153
Synonyms: 4- ({3- [carboxy(1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)methyl]- 1H- indol- 5- yl}amino)- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)Nc1ccc2c(c1)c(c[nH]2)C(N1CC2(CC1CC(C2)(C)C)C)C(=O)O

STL043157
Synonyms: 5- [(4- chlorophenyl)sulfanyl]- 3- methyl- 4- [(4- methylphenyl)sulfonyl]- 1,3- thiazol- 2(3H)- one
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(Sc2ccc(cc2)Cl)sc(=O)n1C

STL043160
Synonyms: 1- methyl- 1- (3- methylbut- 2- en- 1- yl)piperidinium
Smiles: CC(=CC[N+]1(C)CCCCC1)C

STL043168
Synonyms: (2E)- N,N,N,N',N',N',2- heptamethylbut- 2- ene- 1,4- diaminium
Smiles: C/C(=C\C[N+](C)(C)C)/C[N+](C)(C)C

STL043169
Synonyms: 3- amino- 7,7- dimethyl- 7,8- dihydro- 5H- thieno[2,3- b]thiopyrano[3,4- e]pyridine- 2- carboxylate
Smiles: [O-]C(=O)c1sc2c(c1N)cc1c(n2)CC(SC1)(C)C

STL043176
Synonyms: 3- (4- bromophenyl)- 5,6- dihydroimidazo[2,1- b][1,3]thiazol- 7- ium
Smiles: Brc1ccc(cc1)c1csc2=[NH+]CCn12

STL043180
Synonyms: 1- cyclohexyl- 3- (dimethylamino)- 1- [4- (pentyloxy)phenyl]propan- 1- ol
Smiles: CCCCCOc1ccc(cc1)C(C1CCCCC1)(CCN(C)C)O

STL043184
Synonyms: 3- (5,7- dimethyl- 6- oxo- 1,3- diazatricyclo[3.3.1.1~3,7~]dec- 2- yl)- N,N- dimethyl- 1H- indole- 5- sulfonamide
Smiles: CN(S(=O)(=O)c1ccc2c(c1)c(c[nH]2)C1N2CC3(CN1CC(C2)(C3=O)C)C)C

STL043186
Synonyms: 6- {[(2- hydroxyphenyl)carbonyl]amino}hexanoate
Smiles: [O-]C(=O)CCCCCNC(=O)c1ccccc1O

STL043187
Synonyms: (2Z,4E)- 3- methyl- 5- (4- nitrophenyl)penta- 2,4- dienoate
Smiles: [O-]C(=O)/C=C(\C=C\c1ccc(cc1)[N+](=O)[O-])/C

STL043190
Synonyms: 3,4,5- trichloropyridine- 2- carboxylate
Smiles: [O-]C(=O)c1ncc(c(c1Cl)Cl)Cl

STL043193
Synonyms: N- (7- methylidenebicyclo[3.3.1]non- 2- en- 3- yl)acetamide
Smiles: CC(=O)NC1=CC2CC(C1)CC(=C)C2

STL043196
Synonyms: 4- carboxy- N,N- dimethyl- N- [(trimethylsilyl)methyl]butan- 1- aminium
Smiles: OC(=O)CCCC[N+](C[Si](C)(C)C)(C)C

STL043206
Synonyms: 5- (1- benzothiophen- 3- yl)- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- olate
Smiles: [O-]c1[nH]c(=O)[nH]c(=O)c1c1csc2c1cccc2

STL043212
Synonyms: 2- {[(E)- (2- hydroxynaphthalen- 1- yl)methylidene]amino}ethylsulfate
Smiles: Oc1ccc2c(c1/C=N/CCOS(=O)(=O)[O-])cccc2

STL043213
Synonyms: 3- [2- (diethylamino)ethyl]- 2- [4- (dimethylamino)phenyl]- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: CCN(CCN1C(Nc2c(C1=O)cccc2)c1ccc(cc1)N(C)C)CC

STL043225
Synonyms: N,N,N- trimethyl- 2- oxo- 2- [(1,7,7- trimethylbicyclo[2.2.1]hept- 2- yl)oxy]ethanaminium
Smiles: O=C(C[N+](C)(C)C)OC1CC2C(C1(C)CC2)(C)C

STL043231
Synonyms: 1- (1- azabicyclo[2.2.2]oct- 3- yl)- 1- (2- methylphenyl)- 2- phenylethanol
Smiles: Cc1ccccc1C(C1CN2CCC1CC2)(Cc1ccccc1)O