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

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STL043232
Synonyms: 2- [2- (4- methoxyphenyl)- 2- oxoethyl]- 6- methyl- 1- propyl- 3,4- dihydropyrrolo[1,2- a]pyrazin- 2- ium
Smiles: CCCC1=[N+](CCn2c1ccc2C)CC(=O)c1ccc(cc1)OC

STL043237
Synonyms: 2- (4- {2- [(2- bromophenyl)carbonyl]hydrazinyl}- 4- oxobutan- 2- yl)- 5- methylhexanoate
Smiles: CC(CCC(C(CC(=O)NNC(=O)c1ccccc1Br)C)C(=O)[O-])C

STL043239
Synonyms: 4- [(E)- {(E)- phenyl[2- (1H- tetrazol- 5- yl)hydrazinylidene]methyl}diazenyl]benzenesulfonate
Smiles: [O-]S(=O)(=O)c1ccc(cc1)/N=N/C(=N/Nc1nnn[nH]1)/c1ccccc1

STL043242
Synonyms: 5- chloro- 2- ({2- [2- (2- methylpropyl)- 5- oxotetrahydrofuran- 2- yl]- 2- oxoethyl}amino)pyridinium
Smiles: CC(CC1(CCC(=O)O1)C(=O)CNc1ccc(c[nH+]1)Cl)C

STL043244
Synonyms: 1- ethyl- 1- (3- methylbut- 2- en- 1- yl)piperidinium
Smiles: CC[N+]1(CCCCC1)CC=C(C)C

STL043245
Synonyms: 2- (4- {2- [(2- chlorophenyl)carbonyl]hydrazinyl}- 4- oxobutan- 2- yl)hexanoate
Smiles: CCCCC(C(CC(=O)NNC(=O)c1ccccc1Cl)C)C(=O)[O-]

STL043246
Synonyms: 2- {4- [2- (furan- 2- ylcarbonyl)hydrazinyl]- 4- oxobutan- 2- yl}hexanoate
Smiles: CCCCC(C(CC(=O)NNC(=O)c1ccco1)C)C(=O)[O-]

STL043249
Synonyms: 2- (4- methoxyphenyl)- 3- (phenylcarbonyl)indolizine- 7- carboxylate
Smiles: COc1ccc(cc1)c1cc2n(c1C(=O)c1ccccc1)ccc(c2)C(=O)[O-]

STL043253
Synonyms: 1,1'- (benzene- 1,4- diyldiprop- 1- yne- 1,3- diyl)bis(1- benzylpiperidinium)
Smiles: C1CC[N+](CC1)(CC#Cc1ccc(cc1)C#CC[N+]1(CCCCC1)Cc1ccccc1)Cc1ccccc1

STL043259
Synonyms: 3- methyl- N- (1H- tetrazol- 5- yl)tricyclo[3.3.1.1~3,7~]decane- 1- carboxamide
Smiles: O=C(C12CC3CC(C1)CC(C2)(C3)C)Nc1nnn[nH]1

STL043265
Synonyms: ethyl5- fluoro- 3- [(E)- (1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)diazenyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CC3(CC1CC(C3)(C)C)C)cc(cc2)F

STL043267
Synonyms: N- (but- 2- yn- 1- yl)- N,N- dimethyldecan- 1- aminium
Smiles: CCCCCCCCCC[N+](CC#CC)(C)C

STL043268
Synonyms: 3- (4- chlorophenyl)- 4- methyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: [O-]C(=O)c1sc(=S)n(c1C)c1ccc(cc1)Cl

STL043269
Synonyms: 1- {2- [(2E)- 2- (2- hydroxy- 3- methoxybenzylidene)hydrazinyl]- 2- oxoethyl}pyridinium
Smiles: COc1cccc(c1O)/C=N/NC(=O)C[n+]1ccccc1

STL043271
Synonyms: N- [4- chloro- 2- (phenylcarbonyl)phenyl]- 4,7,7- trimethyl- 3- oxobicyclo[2.2.1]heptane- 1- carboxamide
Smiles: Clc1ccc(c(c1)C(=O)c1ccccc1)NC(=O)C12CCC(C2(C)C)(C(=O)C1)C

STL043276
Synonyms: 7- ethyl- 1,3- di(morpholin- 4- yl)- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: CCN1CCc2c(C1)c(nc(c2C#N)N1CCOCC1)N1CCOCC1

STL043277
Synonyms: 2- (dodecyloxy)- N,N,N- trimethyl- 2- oxoethanaminium
Smiles: CCCCCCCCCCCCOC(=O)C[N+](C)(C)C

STL043278
Synonyms: N- benzyl- 3- {[(2E)- 4- ethoxy- 4- oxobut- 2- en- 2- yl]amino}- N,N- dimethylpropan- 1- aminium
Smiles: CCOC(=O)/C=C(/NCCC[N+](Cc1ccccc1)(C)C)\C

STL043279
Synonyms: 2- amino- 3- carbamoylchromenium
Smiles: NC(=O)c1cc2ccccc2[o+]c1N

STL043280
Synonyms: N- (1- benzofuran- 2- ylmethyl)- N,N'- diethyl- N,N',N'- trimethyloctane- 1,8- diaminium
Smiles: CC[N+](Cc1cc2c(o1)cccc2)(CCCCCCCC[N+](CC)(C)C)C

STL043290
Synonyms: 1,1'- (benzene- 1,4- diyldiprop- 1- yne- 1,3- diyl)bis[1- (prop- 2- yn- 1- yl)piperidinium]
Smiles: C#CC[N+]1(CCCCC1)CC#Cc1ccc(cc1)C#CC[N+]1(CCCCC1)CC#C

STL043291
Synonyms: 4- [(1- phenylethyl)amino]- 1- oxaspiro[4.5]dec- 3- en- 2- one
Smiles: CC(c1ccccc1)NC1=CC(=O)OC21CCCCC2

STL043292
Synonyms: 3- benzyl- 8- cyclohexyl- 2,3,3a,4,5,6- hexahydro- 1H- pyrazino[3,2,1- jk]carbazole
Smiles: C1CCC(CC1)c1ccc2c(c1)c1CCCC3c1n2CCN3Cc1ccccc1

STL043297
Synonyms: 1- (1,5- dihydro- 2,4- benzodioxepin- 3- ylmethyl)- 3- methylpyridinium
Smiles: Cc1ccc[n+](c1)CC1OCc2c(CO1)cccc2

STL043300
Synonyms: 2- (dioxido- lambda~5~- phosphanyl)- 3- (furan- 2- yl)propanoate
Smiles: [O-]C(=O)C(P(=O)[O-])Cc1ccco1

STL043302
Synonyms: 2'- (naphthalen- 1- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: N1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1cccc2c1cccc2

STL043311
Synonyms: N- (1- benzofuran- 2- ylmethyl)- N,N,N'- triethyl- N',N'- dimethylpentane- 1,5- diaminium
Smiles: CC[N+](Cc1cc2c(o1)cccc2)(CCCCC[N+](CC)(C)C)CC

STL043312
Synonyms: 1- {2- oxo- 2- [(2E)- 2- (3,4,5- trimethoxybenzylidene)hydrazinyl]ethyl}pyridinium
Smiles: COc1cc(/C=N/NC(=O)C[n+]2ccccc2)cc(c1OC)OC

STL043314
Synonyms: 4- amino- 6- phenoxy- 2- (trifluoromethyl)quinoline- 3- carbonitrile
Smiles: N#Cc1c(N)c2cc(ccc2nc1C(F)(F)F)Oc1ccccc1

STL043327
Synonyms: (2E)- 2- [2- (2- methylquinolin- 4- yl)hydrazinylidene]propanoate
Smiles: Cc1cc(N/N=C(/C(=O)[O-])\C)c2c(n1)cccc2

STL043329
Synonyms: 2- ({[(dimethylamino)methyl]phosphinato}methyl)butanedioate
Smiles: CN(CP(=O)(CC(C(=O)[O-])CC(=O)[O-])[O-])C

STL043331
Synonyms: ethyl3- {[(3- chlorotricyclo[3.3.1.1~3,7~]dec- 1- yl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C13CC4CC(C1)CC(C3)(C4)Cl)cccc2

STL043335
Synonyms: 1- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]piperidinium
Smiles: OC(CN1C(=NC(C1=O)(C)C)O)C[NH+]1CCCCC1

STL043336
Synonyms: 4- {2- [4- phenyl- 2- (propan- 2- yl)tetrahydro- 2H- pyran- 4- yl]ethyl}morpholin- 4- ium
Smiles: CC(C1OCCC(C1)(CC[NH+]1CCOCC1)c1ccccc1)C

STL043337
Synonyms: 1- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]- 3,5- dimethyl- 1H- pyrazol- 2- ium
Smiles: OC(Cn1[nH+]c(cc1C)C)CN1C(=NC(C1=O)(C)C)O

STL043339
Synonyms: 1- (4- ethoxyphenyl)- 2- hydroxy- 6- oxo- 1,6- dihydropyrimidin- 4- olate
Smiles: CCOc1ccc(cc1)n1c(O)nc(cc1=O)[O-]

STL043343
Synonyms: 8,8- dimethyl- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine- 4- thiol
Smiles: Sc1ncnc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STL043344
Synonyms: (5Z)- 5- (5- bromo- 2- methoxybenzylidene)- 3- (4- fluorobenzyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1/C=C\1/C(=NC(=O)N(C1=O)Cc1ccc(cc1)F)O)Br

STL043347
Synonyms: (4E)- 5- (3- bromophenyl)- 4- [furan- 2- yl(hydroxy)methylidene]- 1- {5- [(4- nitrophenyl)sulfonyl]- 1,3- thiazol- 2- yl}pyrrolidine- 2,3- dione
Smiles: Brc1cccc(c1)C1N(c2ncc(s2)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])C(=O)C(=O)/C/1=C(\c1ccco1)/O

STL043351
Synonyms: 2- (4- chlorophenyl)- 2- oxoethyl6- methyl- 2- oxo- 1,2- dihydroquinoline- 4- carboxylate
Smiles: Clc1ccc(cc1)C(=O)COC(=O)c1cc(=O)[nH]c2c1cc(C)cc2

STL043358
Synonyms: 2- hydroxy- 4- {[2- (piperidinium- 1- yl)ethoxy]carbonyl}phenolate
Smiles: O=C(c1ccc(c(c1)O)[O-])OCC[NH+]1CCCCC1

STL043360
Synonyms: (5Z)- 5- ({[4- (diethylamino)phenyl]amino}methylidene)- 3- (4- ethoxyphenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCOc1ccc(cc1)N1C(=O)N=C(/C(=C/Nc2ccc(cc2)N(CC)CC)/C1=O)O

STL043364
Synonyms: methyl4- {(4Z)- 6- amino- 4- [(3,4- dimethylphenyl)imino]- 4,5- dihydro- 1,3,5- triazin- 2- yl}- 3- oxobutanoate
Smiles: COC(=O)CC(=O)Cc1n/c(=N\c2ccc(c(c2)C)C)/[nH]c(n1)N

STL043378
Synonyms: (5E)- 6- hydroxy- 5- {[(4- methylphenyl)amino]methylidene}- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C/Nc2ccc(cc2)C)/C(=N1)O

STL043393
Synonyms: 8- [(3- ethoxypropyl)amino]- 6- hydroxy- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCOCCCNc1nc2c(n1CCC(C)C)c(O)nc(=O)n2C

STL043395
Synonyms: 3- [(4- ethylpiperazin- 4- ium- 1- yl)carbonothioyl]phenolate
Smiles: CC[NH+]1CCN(CC1)C(=S)c1cccc(c1)[O-]

STL043399
Synonyms: (5Z)- 3- (4- ethoxyphenyl)- 6- hydroxy- 5- [(5- methylfuran- 2- yl)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: CCOc1ccc(cc1)N1C(=O)N=C(/C(=C/c2ccc(o2)C)/C1=O)O

STL043407
Synonyms: (6- chloro- 2- hydroxy- 4- phenylquinolin- 3- yl)aceticacid
Smiles: OC(=O)Cc1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STL043415
Synonyms: 4- {(3E)- 2- (2,5- dimethoxyphenyl)- 3- [hydroxy(4- methylphenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}butanoicacid
Smiles: COc1ccc(c(c1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1CCCC(=O)O)OC

STL043418
Synonyms: 4- {[(E)- (3- ethoxy- 4- hydroxyphenyl)methylidene]amino}- 5- (phenoxymethyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cc(ccc1O)/C=N/n1c(COc2ccccc2)n[nH]c1=S

STL043425
Synonyms: 3- [(2,4- dichlorobenzyl)sulfanyl]- 5- propyl- 4H- 1,2,4- triazole
Smiles: CCCc1nnc([nH]1)SCc1ccc(cc1Cl)Cl

STL043434
Synonyms: N- [(E)- (1- methyl- 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)C)S

STL043435
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 6- hydroxy- 3- methyl- 7- (naphthalen- 1- ylmethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN(CCNc1nc2c(n1Cc1cccc3c1cccc3)c(O)nc(=O)n2C)C

STL043436
Synonyms: 6- (methoxycarbonyl)- 2- {(1E)- 1- [(4- methoxyphenyl)iminio]butyl}- 5,5- dimethyl- 3- oxocyclohex- 1- en- 1- olate
Smiles: CCC/C(=[NH+]\c1ccc(cc1)OC)/C1=C([O-])C(C(CC1=O)(C)C)C(=O)OC

STL043451
Synonyms: 5- methoxy- 2- {[(1- methyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: COc1ccc(c(c1)[O-])CNc1[nH+]c2c(n1C)cccc2

STL043457
Synonyms: 7- (2- ethoxyethyl)- 6- hydroxy- 3- methyl- 8- (methylsulfanyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CSc1nc2c(n1CCOCC)c(O)nc(=O)n2C

STL043467
Synonyms: methyl6- hydroxy- 1,3- dimethyl- 2,4- dioxo- N- phenyl- 1,2,3,4- tetrahydropyrimidine- 5- carbimidothioate
Smiles: CS/C(=N\c1ccccc1)/c1c(O)n(C)c(=O)n(c1=O)C

STL043469
Synonyms: (2- oxo- 1,2- dihydroquinolin- 3- yl)methylpyridine- 3- carboxylate
Smiles: O=C(c1cccnc1)OCc1cc2ccccc2[nH]c1=O

STL043473
Synonyms: 2- (4- methoxyphenyl)- N- [(2Z)- 5- methyl- 4- oxo- 1,3- thiazolidin- 2- ylidene]acetamide
Smiles: COc1ccc(cc1)CC(=O)/N=C\1/NC(=O)C(S1)C

STL043483
Synonyms: (5Z)- 3- (2- ethoxyphenyl)- 6- hydroxy- 5- [(piperidin- 1- ylamino)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: CCOc1ccccc1N1C(=O)N=C(/C(=C/NN2CCCCC2)/C1=O)O

STL043487
Synonyms: 4- {(3E)- 2- (4- fluorophenyl)- 3- [hydroxy(4- methylphenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)F)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STL043492
Synonyms: (2Z)- 2- (1H- benzimidazol- 2- yl)- 4- (3,4- dimethoxyphenyl)- 3- hydroxybut- 2- enenitrile
Smiles: COc1cc(ccc1OC)C/C(=C(/c1nc2c([nH]1)cccc2)\C#N)/O

STL043500
Synonyms: (5Z)- 3- butyl- 5- {[1- (3- chloropropyl)- 2,3- dihydro- 1H- indol- 5- yl]methylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCCCN1C(=O)N=C(/C(=C/c2ccc3c(c2)CCN3CCCCl)/C1=O)O

STL043505
Synonyms: 4- [5- (4- chlorophenyl)- 2- (3- nitrophenyl)- 4,6- dioxohexahydro- 2H- pyrrolo[3,4- d][1,2]oxazol- 3- yl]phenylbenzenesulfonate
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)OS(=O)(=O)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STL043514
Synonyms: 8- [4- (2- {[5- bromo- 2- (methoxycarbonyl)- 1H- indol- 3- yl]amino}- 2- oxoethyl)piperazin- 4- ium- 1- yl]- 3- methyl- 2- oxo- 7- propyl- 3,7- dihydro- 2H- purin- 6- olate
Smiles: CCCn1c(nc2c1c([O-])nc(=O)n2C)N1CC[NH+](CC1)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STL043520
Synonyms: 3- fluoro- N- [(4Z)- 2- (2- fluorophenyl)quinazolin- 4(3H)- ylidene]aniline
Smiles: Fc1cccc(c1)/N=c/1\[nH]c(nc2c1cccc2)c1ccccc1F

STL043521
Synonyms: 6- chloro- 4- ethyl- 8- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 2- oxo- 2H- chromen- 7- olate
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2C[NH+]1CCN(CC1)C)[O-]

STL043524
Synonyms: (1E,2E)- 1- {1- [2- (diethylammonio)ethyl]- 2- (3- nitrophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}- 3- phenylprop- 2- en- 1- olate
Smiles: CC[NH+](CCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/C=C/c2ccccc2)\[O-])/C(=O)C1=O)CC

STL043528
Synonyms: 1- {3- (3,4- dimethoxyphenyl)- 1- hydroxy- 11- [4- (trifluoromethyl)phenyl]- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl}hexan- 1- one
Smiles: CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(c(c2)OC)OC)C1c1ccc(cc1)C(F)(F)F

STL043540
Synonyms: 4- (4- ethoxyphenyl)- 7- hydroxy- 1- (pentan- 3- yl)- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: CCOc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C(CC)CC)O

STL043541
Synonyms: (4E)- 4- [hydroxy(4- methylphenyl)methylidene]- 5- [4- (propan- 2- yl)phenyl]- 1- (1,3,4- thiadiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C(C)C)N(C(=O)C1=O)c1scnn1)/O

STL043542
Synonyms: [11- (3- ethoxy- 4- hydroxyphenyl)- 1- hydroxy- 3,3- dimethyl- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl](phenyl)methanone
Smiles: CCOc1cc(ccc1O)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1ccccc1)cccc2)(C)C

STL043555
Synonyms: (5E)- 3- (4- fluorophenyl)- 6- hydroxy- 5- ({1- [2- (2- methoxyphenoxy)ethyl]- 1H- pyrrol- 2- yl}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccccc1OCCn1cccc1/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)F)O

STL043575
Synonyms: 1- [(2Z)- 5- [(2,3- dimethylphenoxy)methyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- (4- methoxyphenyl)urea
Smiles: COc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)COc1cccc(c1C)C

STL043580
Synonyms: (6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl2- fluorobenzoate
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)COC(=O)c1ccccc1F

STL043589
Synonyms: 3- {(1Z)- 1- [2- ([1,2,4]triazolo[4,3- b]pyridazin- 5- ium- 6- yl)hydrazinylidene]ethyl}phenolate
Smiles: [O-]c1cccc(c1)/C(=N\Nc1ccc2n([nH+]1)cnn2)/C

STL043592
Synonyms: N- (6- bromo- 2- hydroxy- 4- phenylquinolin- 3- yl)benzenesulfonamide
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)NS(=O)(=O)c1ccccc1

STL043598
Synonyms: N- (4- ethoxyphenyl)- 2- methoxy- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]acetamide
Smiles: COCC(=O)N(c1ccc(cc1)OCC)Cc1cc2ccc(cc2[nH]c1=O)C

STL043605
Synonyms: ethyl(2E)- 2- cyano- 3- (5,6,7,8- tetrahydro- 2H- pyrazolo[3,4- b]quinolin- 3- ylamino)prop- 2- enoate
Smiles: CCOC(=O)/C(=C/Nc1[nH]nc2c1cc1CCCCc1n2)/C#N

STL043606
Synonyms: 2,4- dibromo- 6- [(E)- {2- [(5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 3- ium- 2- yl)carbonyl]hydrazinylidene}methyl]phenolate
Smiles: Brc1cc(/C=N/NC(=O)c2[nH+]c3n(n2)c(C)cc(n3)C)c(c(c1)Br)[O-]

STL043625
Synonyms: 2- ethyl- 5- hydroxy- 4- [(1- methyl- 1H- benzimidazol- 3- ium- 2- yl)acetyl]phenolate
Smiles: CCc1cc(c(cc1[O-])O)C(=O)Cc1[nH+]c2c(n1C)cccc2

STL043634
Synonyms: (2- oxo- 1,2- dihydroquinolin- 3- yl)methyl3- methoxybenzoate
Smiles: COc1cccc(c1)C(=O)OCc1cc2ccccc2[nH]c1=O

STL043643
Synonyms: (7E)- 7- [(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)iminio]- 4- nitrocyclohepta- 1,3,5- trien- 1- olate
Smiles: [O-][N+](=O)c1ccc(/c(=[NH+]/c2c(C)n(n(c2=O)c2ccccc2)C)/cc1)[O-]

STL043694
Synonyms: N- (2- {2- [(Z)- (4- hydroxy- 2,6- dioxo- 1- phenyl- 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)c2ccccc2)O)[nH]c2c1cccc2

STL043699
Synonyms: (2Z)- 2- [(6- chloro- 4- phenylquinazolin- 2- yl)imino]- 2,5,6,7- tetrahydro- 1H- cyclopenta[d]pyrimidin- 4- ol
Smiles: Clc1ccc2c(c1)c(nc(n2)/N=c/1\nc(O)c2c([nH]1)CCC2)c1ccccc1

STL043708
Synonyms: 1- (2- {[(2E)- 6- ethoxy- 4- methylquinazolin- 2(1H)- ylidene]amino}- 4,6- dimethylpyrimidin- 5- yl)ethanone
Smiles: CCOc1ccc2c(c1)c(C)n/c(=N/c1nc(C)c(c(n1)C)C(=O)C)/[nH]2

STL043709
Synonyms: {(3Z)- 3- [(2Z)- 4- hydroxy- 2- {[3- (trifluoromethyl)phenyl]imino}- 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(c3)C(F)(F)F)/N=C2O)/C1=O

STL043713
Synonyms: 2,3- dihydro- 1H- phenothiazin- 4- ol
Smiles: OC1=C2Sc3ccccc3N=C2CCC1

STL043724
Synonyms: (E)- (4- methoxy- 3- methylphenyl)[2- (2- methoxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1ccccc1C1/C(=C(/c2ccc(c(c2)C)OC)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL043725
Synonyms: 1- [4- (ethoxycarbonyl)phenyl]- 5- [(S)- {1- [4- (ethoxycarbonyl)phenyl]- 4,6- dihydroxy- 2- oxo- 1,2- dihydropyrimidin- 5- yl}(pyridinium- 4- yl)methyl]- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- olate
Smiles: CCOC(=O)c1ccc(cc1)n1c(=O)nc(c(c1O)[C@@H](c1c([O-])[nH]c(=O)n(c1=O)c1ccc(cc1)C(=O)OCC)c1cc[nH+]cc1)O

STL043732
Synonyms: 2- [(1- cyclohexyl- 5- ethyl- 6- hydroxy- 4- oxo- 1,4- dihydropyrimidin- 2- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: CCc1c(=O)nc(n(c1O)C1CCCCC1)SCC(=O)Nc1ccc(cc1)C

STL043733
Synonyms: 5- (4- bromophenyl)- 7- (4- ethylphenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: CCc1ccc(cc1)C1C=C(N=c2n1nc[nH]2)c1ccc(cc1)Br

STL043742
Synonyms: (5Z)- 1- (2- fluorophenyl)- 5- [(piperidin- 1- ylamino)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\NN1CCCCC1)c1ccccc1F

STL043746
Synonyms: 4- (morpholin- 4- yl)- 9- sulfanyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- ol
Smiles: Sc1nc(O)c2c(n1)c1c(s2)nc(c2c1CCC2)N1CCOCC1

STL043748
Synonyms: 2- [(6- chloro- 2- hydroxy- 4- phenylquinolin- 3- yl)sulfanyl]- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STL043749
Synonyms: N- {(E)- amino[(2Z)- 1,3- benzoxazol- 2(3H)- ylideneamino]methylidene}- 2- phenyl- 2- (phenylsulfanyl)acetamide
Smiles: N/C(=N\C(=O)C(c1ccccc1)Sc1ccccc1)/N=c/1\oc2c([nH]1)cccc2

STL043750
Synonyms: 4- [(4- bromo- 1H- pyrazol- 2- ium- 1- yl)methyl]benzoate
Smiles: [O-]C(=O)c1ccc(cc1)Cn1[nH+]cc(c1)Br

STL043760
Synonyms: N- methyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 3- carboxamide
Smiles: O=C(N(Cc1cc2ccccc2[nH]c1=O)C)c1cccnc1

STL043771
Synonyms: 4- [(E)- {2- [(3- hydroxy- 5- methyl- 1H- pyrazol- 4- yl)acetyl]hydrazinylidene}methyl]- 2,6- dimethoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)Cc2c(C)[nH]nc2O)cc(c1OC(=O)C)OC

STL043778
Synonyms: N- [(4E)- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]- 3- methoxyaniline
Smiles: COc1cccc(c1)/N=c\1/nc[nH]c2c1cn[nH]2

STL043790
Synonyms: (5E)- 5- ({1- [2- (2- fluorophenoxy)ethyl]- 1H- indol- 3- yl}methylidene)- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccccc2F)/C(=N1)O

STL043805
Synonyms: N'- [(E)- (1- butyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]pentanehydrazide
Smiles: CCCCC(=O)NN/C=C/1\C(=O)N=C(N(C1=O)CCCC)S

STL043807
Synonyms: (2- oxo- 1,2- dihydroquinolin- 3- yl)methylfuran- 2- carboxylate
Smiles: O=C(c1ccco1)OCc1cc2ccccc2[nH]c1=O

STL043814
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (pyridin- 4- yl)pyrrolidin- 3- ylidene](4- methoxy- 3- methylphenyl)methanolate
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)Cc1ccc[nH+]c1)/[O-]

STL043822
Synonyms: 2- methoxy- N- methyl- 5- {[(1Z)- 4- methylphthalazin- 1(2H)- ylidene]amino}benzamide
Smiles: CNC(=O)c1cc(ccc1OC)/N=c/1\[nH]nc(c2c1cccc2)C

STL043830
Synonyms: 4- {(E)- [(3- cyclohexyl- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl)imino]methyl}- 2,6- dimethoxyphenylacetate
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2C2CCCCC2)cc(c1OC(=O)C)OC

STL043833
Synonyms: 4- benzyl- 5- (4- butoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCCCOc1ccc(cc1)c1n[nH]c(=S)n1Cc1ccccc1

STL043846
Synonyms: N- butyl- 3,4- dimethoxy- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: CCCCN(C(=O)c1ccc(c(c1)OC)OC)Cc1cc2cc(C)ccc2[nH]c1=O

STL043855
Synonyms: N'- [(E)- (2,4- dihydroxy- 6- methylpyrimidin- 5- yl)methylidene]- 4- propoxybenzohydrazide
Smiles: CCCOc1ccc(cc1)C(=O)N/N=C/c1c(C)nc(nc1O)O

STL043863
Synonyms: 4- hydroxy- 2,6- diphenyl- 3- (propan- 2- yl)- 4- propylpiperidinium
Smiles: CCCC1(O)CC([NH2+]C(C1C(C)C)c1ccccc1)c1ccccc1

STL043867
Synonyms: 2- {[3- cyano- 5- hydroxy- 4- (2- methylphenyl)- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (3- methoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)OC)N=C2C(=C(O)CCC2)C1c1ccccc1C

STL043878
Synonyms: N- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]- N- (3- nitrophenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccccc1)c1cccc(c1)[N+](=O)[O-])CN1C(=NC(C1=O)(C)C)O

STL043879
Synonyms: 5- [2- (morpholin- 4- yl)ethyl]- 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)CCN3CCOCC3)/[nH]c2cc1C

STL043906
Synonyms: N- [(3- chloro- 2- hydroxy- 5- nitrophenyl)carbamothioyl]benzamide
Smiles: S=C(Nc1cc(cc(c1O)Cl)[N+](=O)[O-])NC(=O)c1ccccc1

STL043907
Synonyms: {(3E)- 3- [hydroxy(4- methylphenyl)methylidene]- 4,5- dioxo- 2- phenylpyrrolidin- 1- yl}aceticacid
Smiles: OC(=O)CN1C(c2ccccc2)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STL043911
Synonyms: 4- {(1E)- N- [4- (4- chlorophenyl)piperazin- 4- ium- 1- yl]propanimidoyl}phenolate
Smiles: CC/C(=N\N1CC[NH+](CC1)c1ccc(cc1)Cl)/c1ccc(cc1)[O-]

STL043913
Synonyms: 1- (4- ethoxyphenyl)- 3- [(2E)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: CCOc1ccc(cc1)NC(=O)/N=c/1\[nH]nc(s1)C

STL043917
Synonyms: 2- hydroxy- 1- (3- methylbutyl)- 4- oxo- N- (pyridin- 3- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CC(CCn1c(O)c(C(=O)Nc2cccnc2)c(=O)c2c1cccc2)C

STL043918
Synonyms: (4E)- 5- (2- fluorophenyl)- 1- (2- hydroxyethyl)- 4- [(2E)- 1- hydroxy- 3- phenylprop- 2- en- 1- ylidene]pyrrolidine- 2,3- dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\C=C\c2ccccc2)/O)/C1c1ccccc1F

STL043919
Synonyms: 4- [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (3,4- dimethoxyphenyl)- 4,5- dioxopyrrolidin- 1- yl]butanoicacid
Smiles: COc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCCC(=O)O

STL043924
Synonyms: 4- fluoro- N- [(4E)- 1- phenyl- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]aniline
Smiles: Fc1ccc(cc1)/N=c\1/nc[nH]c2c1cnn2c1ccccc1

STL043927
Synonyms: 3- (1- methyl- 1H- benzimidazol- 2- yl)- 8- (morpholin- 4- ium- 4- ylmethyl)- 2- oxo- 2H- chromen- 7- olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCOCC1)oc(=O)c(c2)c1nc2c(n1C)cccc2

STL043933
Synonyms: (5Z)- 6- hydroxy- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)- 3- (4- methoxybenzyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)CN1C(=O)N=C(/C(=C/NCCCn2cncc2)/C1=O)O

STL043936
Synonyms: (4E)- 4- [hydroxy(5- methylfuran- 2- yl)methylidene]- 5- [3- methoxy- 4- (pentyloxy)phenyl]- 1- (5- methyl- 1,2- oxazol- 3- yl)pyrrolidine- 2,3- dione
Smiles: CCCCCOc1ccc(cc1OC)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1noc(c1)C

STL043939
Synonyms: (5Z)- 6- hydroxy- 3- (4- methoxyphenyl)- 5- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C/NCCCN2CCOCC2)/C1=O)O

STL043945
Synonyms: 4- [5- (2- hydroxy- 8- methylquinolin- 3- yl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cc2cccc(c2nc1O)C)c1ccccc1

STL043946
Synonyms: (E)- {1- [3- (dimethylammonio)propyl]- 2- (4- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(thiophen- 2- yl)methanolate
Smiles: Fc1ccc(cc1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

STL043952
Synonyms: (E)- [2- (2- fluorophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](4- propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)Cc1ccc[nH+]c1)/[O-]

STL043964
Synonyms: N- [(2E)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 7- hydroxy- 5- oxo- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: CCc1n[nH]/c(=N\C(=O)c2c(O)c3cccc4c3n(c2=O)CCC4)/s1

STL043968
Synonyms: 5- fluoro- 2- hydroxy- 6'- methyl- 2'- (methylsulfanyl)- 4H- 1,4'- bipyrimidin- 4- one
Smiles: CSc1nc(C)cc(n1)n1cc(F)c(=O)nc1O

STL043969
Synonyms: N- (3- fluorobenzyl)- 3- hydroxy- 1- oxo- 6,7- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 2- carboxamide
Smiles: Fc1cccc(c1)CNC(=O)c1c(=O)c2cccc3c2n(c1O)CCC3

STL043975
Synonyms: N- [2- (2- {(Z)- [1- (2- fluorophenyl)- 2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 1H- indol- 3- yl)ethyl]acetamide
Smiles: CC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)c2ccccc2F)O)[nH]c2c1cccc2

STL043998
Synonyms: (4- {(E)- [1- (4- ethylphenyl)- 2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}phenoxy)aceticacid
Smiles: CCc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(cc2)OCC(=O)O)/C1=O)O

STL043999
Synonyms: (5Z)- 3- benzyl- 5- [(1- ethyl- 2,3- dihydro- 1H- indol- 5- yl)methylidene]- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCN1CCc2c1ccc(c2)/C=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O

STL044002
Synonyms: 5- cyclopropyl- 5- methyl- 2- phenyl- 2,5- dihydro- 1H- 1,2,4- triazole- 3- thiol
Smiles: SC1=NC(NN1c1ccccc1)(C)C1CC1

STL044009
Synonyms: N- ethyl- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]furan- 2- carboxamide
Smiles: CCN(C(=O)c1ccco1)Cc1cc2cc(OC)ccc2[nH]c1=O

STL044018
Synonyms: N,N'- benzene- 1,3- diylbis[2- (4- hydroxy- 2- oxo- 2,5- dihydro- 1,3- thiazol- 5- yl)acetamide]
Smiles: O=C(Nc1cccc(c1)NC(=O)CC1SC(=O)N=C1O)CC1SC(=O)N=C1O

STL044020
Synonyms: 1- (4,6- dimethylpyrimidin- 2- yl)- 2- (6- methylpyridin- 2- yl)guanidine
Smiles: Cc1cccc(n1)/N=C(/Nc1nc(C)cc(n1)C)\N

STL044023
Synonyms: (5Z)- 5- ({[4- (diethylamino)phenyl]amino}methylidene)- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CCN(c1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)CC

STL044032
Synonyms: 2- hydroxy- N'- {(E)- [1- (3- methoxyphenyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}benzohydrazide
Smiles: COc1cccc(c1)N1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2O)/C1=O)S

STL044044
Synonyms: 5- {2- [4- (propan- 2- yloxy)phenyl]ethyl}- 4- (prop- 2- en- 1- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: C=CCn1c(CCc2ccc(cc2)OC(C)C)n[nH]c1=S

STL044061
Synonyms: 4- hydroxy- 2- oxo- N- [(2E)- 5- propyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: CCCc1n[nH]/c(=N\C(=O)c2c(=O)[nH]c3c(c2O)CCCC3)/s1

STL044065
Synonyms: 1- butyl- 2- hydroxy- 4- oxo- N- (pyrazin- 2- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCn1c(O)c(C(=O)Nc2cnccn2)c(=O)c2c1cccc2

STL044068
Synonyms: (5Z)- 5- (4- fluorobenzylidene)- 6- hydroxy- 3- (3- methoxyphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cccc(c1)N1C(=O)N=C(/C(=C/c2ccc(cc2)F)/C1=O)O

STL044099
Synonyms: 1- [N'- (4,6- dimethylpyrimidin- 2- yl)- N- (phenylacetyl)carbamimidoyl]piperidine- 4- carboxamide
Smiles: O=C(N/C(=N/c1nc(C)cc(n1)C)/N1CCC(CC1)C(=O)N)Cc1ccccc1

STL044118
Synonyms: N- (5,7- diphenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)acetamide
Smiles: CC(=O)Nc1nn2c(=NC(=CC2c2ccccc2)c2ccccc2)[nH]1

STL044119
Synonyms: 3- (6- sulfanyl- 9H- purin- 9- yl)propanenitrile
Smiles: N#CCCn1cnc2c1ncnc2S

STL044123
Synonyms: (5E)- 1- (3- methylphenyl)- 5- ({[2- (piperidin- 1- yl)ethyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Cc1cccc(c1)N1C(=NC(=O)/C(=C\NCCN2CCCCC2)/C1=O)S

STL044126
Synonyms: 6- methyl- 2- phenyl- 1,2,4- triazaspiro[4.5]dec- 3- ene- 3- thiol
Smiles: SC1=NC2(NN1c1ccccc1)CCCCC2C

STL044135
Synonyms: 4- {[(E)- (4- methoxyphenyl)methylidene]amino}- 5- (phenoxymethyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)/C=N/n1c(COc2ccccc2)n[nH]c1=S

STL044143
Synonyms: (5Z)- 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 6- hydroxy- 5- {[(3- hydroxypropyl)amino]methylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: OCCCN/C=C\1/C(=NC(=O)N(C1=O)CCC1=CCCCC1)O

STL044158
Synonyms: 7- (3- bromobenzyl)- 8- {[2- (dimethylamino)ethyl]amino}- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN(CCNc1nc2c(n1Cc1cccc(c1)Br)c(O)nc(=O)n2C)C

STL044162
Synonyms: (E)- {1- [2- (dimethylammonio)ethyl]- 2- (4- methylphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(2,4- dimethyl- 1,3- thiazol- 5- yl)methanolate
Smiles: Cc1ccc(cc1)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[O-]

STL044175
Synonyms: N- cyclohexyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]cyclohexanecarboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)C1CCCCC1)C1CCCCC1

STL044186
Synonyms: N'- [(E)- (1- ethyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]benzohydrazide
Smiles: CCN1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2)/C1=O)S

STL044188
Synonyms: 4- [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (4- methylphenyl)- 4,5- dioxopyrrolidin- 1- yl]butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)C)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STL044217
Synonyms: 4- benzyl- 5- [(2- methylphenoxy)methyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccccc1OCc1n[nH]c(=S)n1Cc1ccccc1

STL044229
Synonyms: N,N- diethyl- 5- (4- hydroxyphthalazin- 1- yl)- 2- methylbenzenesulfonamide
Smiles: CCN(S(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)O)CC

STL044246
Synonyms: 2- [(1,5- dicyano- 4- hydroxy- 3- azaspiro[5.5]undeca- 1,3- dien- 2- yl)sulfanyl]- N- (2,4- dimethylphenyl)acetamide
Smiles: N#CC1C(=NC(=C(C21CCCCC2)C#N)SCC(=O)Nc1ccc(cc1C)C)O

STL044249
Synonyms: 6- chloro- 3- [(Z)- 2- hydroxy- 2- phenylethenyl]- 2H- 1,4- benzoxazin- 2- one
Smiles: Clc1ccc2c(c1)nc(c(=O)o2)/C=C(/c1ccccc1)\O

STL044252
Synonyms: (E)- [2- (2- fluorophenyl)- 4,5- dioxo- 1- (pyridinium- 3- yl)pyrrolidin- 3- ylidene](phenyl)methanolate
Smiles: [O-]/C(=C/1\C(c2ccccc2F)N(C(=O)C1=O)c1ccc[nH+]c1)/c1ccccc1

STL044255
Synonyms: 2- methyl- 5- [(2- methyl- 1H- benzimidazol- 6- yl)methyl]- 1H- benzimidazole
Smiles: Cc1[nH]c2c(n1)cc(cc2)Cc1ccc2c(c1)[nH]c(n2)C

STL044258
Synonyms: 11- hydroxy- 7,7- dimethyl- 10- (pyridin- 3- yl)- 6,7,8,10- tetrahydro- 9H- indeno[1,2- b]quinolin- 9- one
Smiles: O=C1CC(C)(C)CC2=C1C(c1cccnc1)C1=C(O)c3c(C1=N2)cccc3

STL044282
Synonyms: 3- cyclohexyl- 2- sulfanyl- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Sc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCCC3

STL044284
Synonyms: N- [4- hydroxy- 2,6- dioxo- 1- phenyl- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]acetamide
Smiles: CC(=O)NC1(C(=O)Nc2c1c(O)nc(=O)n2c1ccccc1)C(F)(F)F

STL044295
Synonyms: N'- {(Z)- [4- hydroxy- 1- (3- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}pyridine- 4- carbohydrazide
Smiles: Cc1cccc(c1)N1C(=O)N=C(/C(=C/NNC(=O)c2ccncc2)/C1=O)O

STL044299
Synonyms: N- ethyl- 4- methyl- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: CCN(C(=O)c1ccc(cc1)C)Cc1cc2cc(C)ccc2[nH]c1=O

STL044311
Synonyms: N- (4- ethoxyphenyl)- 2,2- dimethyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]propanamide
Smiles: CCOc1ccc(cc1)N(C(=O)C(C)(C)C)Cc1cc2ccccc2[nH]c1=O

STL044312
Synonyms: (E)- (4- chlorophenyl){2- (4- fluorophenyl)- 1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL044316
Synonyms: 2- {(4Z)- 4- [(2- methoxyphenyl)imino]- 3,4- dihydroquinazolin- 2- yl}phenol
Smiles: COc1ccccc1/N=c/1\[nH]c(nc2c1cccc2)c1ccccc1O

STL044317
Synonyms: (5E)- 5- {[(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)amino]methylidene}- 1- (2- fluorophenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/Nc1c(C)n(n(c1=O)c1ccccc1)C)c1ccccc1F

STL044320
Synonyms: N- acetyl- N- [(5E)- 5- (acetylimino)- 4,5- dihydro- 1H- tetrazol- 1- yl]acetamide
Smiles: CC(=O)/N=c/1\[nH]nnn1N(C(=O)C)C(=O)C

STL044331
Synonyms: (E)- {1- [2- (dimethylammonio)ethyl]- 2- (2- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(thiophen- 2- yl)methanolate
Smiles: C[NH+](CCN1C(=O)C(=O)/C(=C(\c2cccs2)/[O-])/C1c1ccccc1F)C

STL044350
Synonyms: (5Z)- 5- {[(1- benzylpiperidin- 4- yl)amino]methylidene}- 3- (furan- 2- ylmethyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/NC2CCN(CC2)Cc2ccccc2)/C(=O)N1Cc1ccco1

STL044361
Synonyms: (5Z)- 5- ({[4- (diethylamino)phenyl]amino}methylidene)- 6- hydroxy- 3- (2,4,6- trimethylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CCN(c1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)c1c(C)cc(cc1C)C)O)CC

STL044373
Synonyms: 4- hydroxy- 2- oxo- N- [(2E)- 4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2(3H)- ylidene]- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: O=C(c1c(=O)[nH]c2c(c1O)CCCC2)/N=c\1/scc([nH]1)C12CC3CC(C2)CC(C1)C3

STL044374
Synonyms: 1'- methyl- 2'- sulfanyl- 5',6',7',8'- tetrahydro- 1'H- spiro[cyclohexane- 1,4'- quinazolin]- 8a'(4a'H)- ol
Smiles: SC1=NC2(CCCCC2)C2C(N1C)(O)CCCC2

STL044376
Synonyms: 3- {(E)- [(2E)- (6- methyl- 4- phenylquinazolin- 2(3H)- ylidene)hydrazinylidene]methyl}quinolin- 2(1H)- one
Smiles: Cc1ccc2c(c1)c([nH]/c(=N\N=C\c1cc3ccccc3[nH]c1=O)/n2)c1ccccc1

STL044382
Synonyms: (5E)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 2- sulfanyl- 1- [3- (trifluoromethyl)phenyl]pyrimidine- 4,6(1H,5H)- dione
Smiles: CN(CCCN/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S)C

STL044383
Synonyms: N- (3,4- dichlorophenyl)- 2- {[(2E)- 4,6- dimethylpyrimidin- 2(1H)- ylidene]amino}- 3a,4,5,6,7,7a- hexahydro- 1H- benzimidazole- 1- carboxamide
Smiles: Cc1cc(C)[nH]/c(=N\C2=NC3C(N2C(=O)Nc2ccc(c(c2)Cl)Cl)CCCC3)/n1

STL044384
Synonyms: 2- ethoxy- N- [(7E)- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(4H)- ylidene]aniline
Smiles: CCOc1ccccc1/N=c/1\cc(C)[nH]c2n1ncn2

STL044386
Synonyms: N- [(1Z)- 4- methylphthalazin- 1(2H)- ylidene]naphthalen- 1- amine
Smiles: Cc1n[nH]/c(=N\c2cccc3c2cccc3)/c2c1cccc2

STL044388
Synonyms: 5- (2,3- dimethoxyphenyl)- 4- hydroxy- 1,3- dimethyl- 3,5- dihydro- 1H- indeno[2',1':5,6]pyrido[2,3- d]pyrimidine- 2,6- dione
Smiles: COc1cccc(c1OC)C1C2=C(N=c3c1c(O)n(C)c(=O)n3C)c1c(C2=O)cccc1

STL044389
Synonyms: 8- {[(2,4- dichlorophenyl)carbonyl]oxy}- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinolinium- 4- carboxylate
Smiles: [O-]C(=O)C1[NH2+]c2ccc(cc2C2C1CC=C2)OC(=O)c1ccc(cc1Cl)Cl

STL044401
Synonyms: (E)- [2- (4- hydroxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](4- methoxy- 3- methylphenyl)methanolate
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)Cc1ccc[nH+]c1)/[O-]

STL044410
Synonyms: (5Z)- 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 6- hydroxy- 5- {[(tetrahydrofuran- 2- ylmethyl)amino]methylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/NCC2CCCO2)/C(=O)N1CCC1=CCCCC1

STL044429
Synonyms: 4- ethoxy- N- (4- hydroxy- 2- oxo- 1,2- dihydropyrimidin- 5- yl)benzamide
Smiles: CCOc1ccc(cc1)C(=O)Nc1c[nH]c(=O)nc1O

STL044432
Synonyms: 2- {(E)- [2- ({4- [(4- bromophenyl)sulfonyl]piperazin- 1- ium- 1- yl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: O=C(C[NH+]1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1ccccc1C(=O)[O-]

STL044435
Synonyms: N- (1- hydroxy- 2- methylpropan- 2- yl)- 2- methyl- 5- {(4Z)- 4- [(2- methylphenyl)imino]- 3,4- dihydrophthalazin- 1- yl}benzenesulfonamide
Smiles: OCC(NS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N\c2ccccc2C)/c2c1cccc2)(C)C

STL044440
Synonyms: methyl2- [({[(5Z)- 5- {[(2- chlorophenyl)carbonyl]imino}- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CSc1n[nH]/c(=N/C(=O)c2ccccc2Cl)/s1

STL044465
Synonyms: (5Z)- 5- [4- (dimethylamino)benzylidene]- 4- sulfanyl- 1,3- oxazole- 2(5H)- thione
Smiles: CN(c1ccc(cc1)/C=C/1\OC(=S)N=C1S)C

STL044477
Synonyms: (4E)- 5- (3- ethoxy- 4- hydroxyphenyl)- 4- [furan- 2- yl(hydroxy)methylidene]- 1- (2- methoxyethyl)pyrrolidine- 2,3- dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(c(c1)OCC)O

STL044479
Synonyms: pentyl2- (4- hydroxy- 6- methyl- 2- sulfanylpyrimidin- 5- yl)propanoate
Smiles: CCCCCOC(=O)C(c1c(C)nc(nc1O)S)C

STL044481
Synonyms: 6- chloro- 3- ethyl- 4- methyl- 2- oxo- 8- (piperidinium- 1- ylmethyl)- 2H- chromen- 7- olate
Smiles: CCc1c(=O)oc2c(c1C)cc(c(c2C[NH+]1CCCCC1)[O-])Cl

STL044485
Synonyms: 2- (4- {[(1E)- 4- [3- (dimethylsulfamoyl)- 4- methylphenyl]phthalazin- 1(2H)- ylidene]amino}phenoxy)- N- methylacetamide
Smiles: CNC(=O)COc1ccc(cc1)/N=c\1/[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N(C)C)C

STL044491
Synonyms: 4- [({[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 2- ium- 3- yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)[O-])[nH+]nc1c1cccnc1

STL044499
Synonyms: 4- {[(E)- (1- cyclopropyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]amino}benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/C=C/1\C(=O)N=C(N(C1=O)C1CC1)S

STL044501
Synonyms: 6,8- dimethyl- 2,5- dihydro- 3H- [1,2,4]triazino[5,6- b]indole- 3- thione
Smiles: Cc1cc(C)c2c(c1)c1n[nH]c(=S)nc1[nH]2

STL044502
Synonyms: (2Z)- 2- (1H- benzimidazol- 2- yl)- 3- hydroxy- 3- (thiophen- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C(\c1cccs1)/O)/c1nc2c([nH]1)cccc2

STL044505
Synonyms:
Smiles: OC(=O)c1cc(cc(c1)C(=O)O)NS(=O)(=O)c1cccc2c1nsn2

STL044506
Synonyms: (E)- (4- fluorophenyl){1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 2- (4- methoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL044508
Synonyms: 1- [(E)- amino{[(2Z)- 4,6,7- trimethylquinazolin- 2(3H)- ylidene]amino}methylidene]- 3- cyclohexylurea
Smiles: N/C(=N\C(=O)NC1CCCCC1)/N=c\1/[nH]c(C)c2c(n1)cc(c(c2)C)C

STL044519
Synonyms: 2- (8,9- diphenylfuro[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 1- ium- 2- yl)naphthalen- 1- olate
Smiles: [O-]c1c(ccc2c1cccc2)c1[nH+]c2n(n1)cnc1c2c(c2ccccc2)c(o1)c1ccccc1

STL044530
Synonyms: 3- {5- [(4- chlorophenyl)ammonio]- 2,4- dioxo- 1,3- thiazolidin- 3- yl}propanoate
Smiles: [O-]C(=O)CCN1C(=O)SC(C1=O)[NH2+]c1ccc(cc1)Cl

STL044536
Synonyms: [(3E)- 3- [hydroxy(phenyl)methylidene]- 2- (4- methylphenyl)- 4,5- dioxopyrrolidin- 1- yl]aceticacid
Smiles: OC(=O)CN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)C

STL044544
Synonyms: (5Z)- 5- ({[3- (diethylamino)propyl]amino}methylidene)- 3- (3,4- dimethylphenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCN(CCCN/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O)CC

STL044574
Synonyms: 2- methoxy- N- (5- methyl- 7- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)benzamide
Smiles: COc1ccccc1C(=O)Nc1nn2c(=NC(=CC2c2ccccc2)C)[nH]1

STL044584
Synonyms: 1- (4- ethoxyphenyl)- 3- [(2E)- 4- hydroxy- 5,6,7,8- tetrahydroquinazolin- 2(1H)- ylidene]guanidine
Smiles: CCOc1ccc(cc1)NC(=N)/N=c\1/nc(O)c2c([nH]1)CCCC2

STL044590
Synonyms: ethyl(2Z)- 4- methyl- 2- ({[(morpholin- 4- ylcarbonothioyl)sulfanyl]acetyl}imino)- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CCOC(=O)c1s/c(=N\C(=O)CSC(=S)N2CCOCC2)/[nH]c1C

STL044595
Synonyms: (5Z)- 1- acetyl- 5- [(2- hydroxy- 6- methoxyquinolin- 3- yl)methylidene]- 2- sulfanyl- 1,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1ccc2c(c1)cc(c(n2)O)/C=C\1/C(=O)N=C(N1C(=O)C)S

STL044596
Synonyms: 1- (2- {[(2E)- 4,6- dimethylquinazolin- 2(1H)- ylidene]amino}- 4- methylpyrimidin- 5- yl)ethanone
Smiles: Cc1ccc2c(c1)c(C)n/c(=N/c1ncc(c(n1)C)C(=O)C)/[nH]2

STL044601
Synonyms: N- [N- (4,6- dimethylpyrimidin- 2- yl)- N'- (4- fluorophenyl)carbamimidoyl]- 2- methylpropanamide
Smiles: O=C(C(C)C)N/C(=N\c1ccc(cc1)F)/Nc1nc(C)cc(n1)C

STL044614
Synonyms: (E)- [2- (4- chlorophenyl)- 4,5- dioxo- 1- (pyridinium- 2- yl)pyrrolidin- 3- ylidene](4- methoxyphenyl)methanolate
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)c1cccc[nH+]1)/[O-]

STL044617
Synonyms: 2- {[(2E)- 4,7- dimethylquinazolin- 2(3H)- ylidene]amino}- 7,8- dihydroquinazolin- 5(6H)- one
Smiles: Cc1ccc2c(c1)n/c(=N/c1ncc3c(n1)CCCC3=O)/[nH]c2C

STL044621
Synonyms: methyl6- {[2- (benzylamino)- 2- oxoethyl]sulfanyl}- 4- (4- chlorophenyl)- 5- cyano- 2- hydroxy- 3,4- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)NCc1ccccc1)O

STL044628
Synonyms: 2- (4,6- dimethylpyrimidin- 2- yl)- 1- [2- (4- methoxyphenyl)ethyl]guanidine
Smiles: COc1ccc(cc1)CCN/C(=N/c1nc(C)cc(n1)C)/N

STL044631
Synonyms: 6- bromo- 4- phenyl- 3- (piperidin- 1- ylmethyl)quinolin- 2- ol
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)CN1CCCCC1

STL044632
Synonyms: 4- hydroxy- N- (3- hydroxypyridin- 2- yl)- 6- oxo- 1,2- dihydro- 6H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: O=C(c1c(O)n2CCc3c2c(c1=O)ccc3)Nc1ncccc1O

STL044649
Synonyms: (2Z)- 1- (2,4- dimethyl- 1,3- oxazol- 5- yl)- 2- (3- hydroxyquinoxalin- 2(1H)- ylidene)ethanone
Smiles: Cc1nc(c(o1)C(=O)/C=c/1\[nH]c2ccccc2nc1O)C

STL044652
Synonyms: 3- [(1Z)- 2- hydroxy- 3,3- dimethylbut- 1- en- 1- yl]- 6- methyl- 2H- 1,4- benzoxazin- 2- one
Smiles: Cc1ccc2c(c1)nc(c(=O)o2)/C=C(/C(C)(C)C)\O

STL044656
Synonyms: 4- bromo- 2- {[(1- propyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: CCCn1c(NCc2cc(Br)ccc2[O-])[nH+]c2c1cccc2

STL044657
Synonyms: {2- [(Z)- (1- cyclohexyl- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccccc1/C=C\1/C(=NC(=O)N(C1=O)C1CCCCC1)O

STL044659
Synonyms: 2- (4- {[(1Z)- 4- {3- [(1- hydroxy- 2- methylpropan- 2- yl)sulfamoyl]- 4- methylphenyl}phthalazin- 1(2H)- ylidene]amino}phenoxy)acetamide
Smiles: OCC(NS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N\c2ccc(cc2)OCC(=O)N)/c2c1cccc2)(C)C

STL044670
Synonyms: 2,6- di- tert- butyl- 4- [(E)- (2- {[(4- methyl- 4H- 1,2,4- triazol- 2- ium- 3- yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: O=C(CSc1[nH+]ncn1C)N/N=C/c1cc(c(c(c1)C(C)(C)C)[O-])C(C)(C)C

STL044685
Synonyms: 8- {[2- (diethylamino)ethyl]amino}- 6- hydroxy- 3- methyl- 3,9- dihydro- 2H- purin- 2- one
Smiles: CCN(CCNc1nc2c([nH]1)n(C)c(=O)nc2O)CC

STL044690
Synonyms: N- [4- cyano- 2- hydroxy- 5- methyl- 3- (trifluoromethyl)- 3H- pyrrol- 3- yl]- 4- (propan- 2- yloxy)benzamide
Smiles: N#CC1=C(C)N=C(C1(NC(=O)c1ccc(cc1)OC(C)C)C(F)(F)F)O

STL044701
Synonyms: 2- {[(7E)- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(4H)- ylidene]amino}benzoicacid
Smiles: OC(=O)c1ccccc1/N=c/1\cc(C)[nH]c2n1ncn2

STL044710
Synonyms: 4- chloro- 2- {1- [(1- ethyl- 1H- benzimidazol- 3- ium- 2- yl)amino]ethyl}phenolate
Smiles: CCn1c(NC(c2cc(Cl)ccc2[O-])C)[nH+]c2c1cccc2

STL044718
Synonyms: 2,4- dibromo- 6- {[(1- ethyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: CCn1c(NCc2cc(Br)cc(c2[O-])Br)[nH+]c2c1cccc2

STL044721
Synonyms: 2- 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)c1ccccc1F)C

STL044722
Synonyms: N- [N'- (4- fluorophenyl)- N- (4- oxo- 6- propyl- 1,4- dihydropyrimidin- 2- yl)carbamimidoyl]benzamide
Smiles: CCCc1cc(=O)nc([nH]1)N/C(=N\c1ccc(cc1)F)/NC(=O)c1ccccc1

STL044728
Synonyms: (5E)- 1- ethyl- 5- [(morpholin- 4- ylamino)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCN1C(=NC(=O)/C(=C\NN2CCOCC2)/C1=O)S

STL044737
Synonyms: (2E)- 5,5- bis(hydroxymethyl)- 2- [(3- hydroxyphenyl)imino]- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: OCC1(CO)S/C(=N/c2cccc(c2)O)/N=C1O

STL044738
Synonyms: 2- methylpyrimido[1,2- a]benzimidazol- 4(10H)- one
Smiles: Cc1cc(=O)n2c(n1)[nH]c1c2cccc1

STL044745
Synonyms: N'- {(E)- [1- (2,5- dimethoxyphenyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 2- hydroxybenzohydrazide
Smiles: COc1ccc(c(c1)N1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2O)/C1=O)S)OC

STL044751
Synonyms: (5Z)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]- 1- phenyl- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\C=C\c1ccco1)c1ccccc1

STL044764
Synonyms: 6- hydroxy- 3- methyl- 8- {[2- (piperidin- 1- yl)ethyl]sulfanyl}- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: C=CCn1c(SCCN2CCCCC2)nc2c1c(O)nc(=O)n2C

STL044769
Synonyms: (2Z)- 4,6- diphenyl- 2- [(2Z)- (pyridin- 4- ylmethylidene)hydrazinylidene]- 1,2- dihydropyrimidine
Smiles: n1ccc(cc1)/C=N\N=c\1/nc(cc([nH]1)c1ccccc1)c1ccccc1

STL044787
Synonyms: 3- fluoro- N- [(4E)- 1- (3- methylphenyl)- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]aniline
Smiles: Fc1cccc(c1)/N=c\1/nc[nH]c2c1cnn2c1cccc(c1)C

STL044792
Synonyms: 1- benzyl- 2- hydroxy- 4- oxo- N- (pyridin- 4- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: O=C(c1c(=O)c2ccccc2n(c1O)Cc1ccccc1)Nc1ccncc1

STL044799
Synonyms: 2- (5- bromo- 2,3- dihydroxy- 3H- indol- 3- yl)cyclohexanone
Smiles: O=C1CCCCC1C1(O)C(=Nc2c1cc(Br)cc2)O

STL044809
Synonyms: (2- {(Z)- [1- (4- fluorophenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}phenoxy)aceticacid
Smiles: OC(=O)COc1ccccc1/C=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)F)O

STL044814
Synonyms: (3E)- 1- (5- bromo- 2,3- dihydroxy- 3H- indol- 3- yl)- 4- (furan- 2- yl)but- 3- en- 2- one
Smiles: O=C(CC1(O)C(=Nc2c1cc(Br)cc2)O)/C=C/c1ccco1

STL044835
Synonyms: 1- butyl- 2- hydroxy- 4- oxo- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCn1c(O)c(C(=O)NC23CC4CC(C3)CC(C2)C4)c(=O)c2c1cccc2

STL044838
Synonyms: 2- methyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- phenylpropanamide
Smiles: CC(C(=O)N(c1ccccc1)Cc1cc2ccccc2[nH]c1=O)C

STL044841
Synonyms: (E)- (4- methoxyphenyl)[2- (4- nitrophenyl)- 4,5- dioxo- 1- (pyridinium- 2- yl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1cccc[nH+]1)/[O-]

STL044854
Synonyms: 2- methoxy- 6- {[(1- propyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: CCCn1c(NCc2cccc(c2[O-])OC)[nH+]c2c1cccc2

STL044858
Synonyms: (E)- (2- methylimidazo[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)nc2n1cccc2)\[O-])c1cccs1)CC[NH+]1CCOCC1

STL044859
Synonyms: (5E)- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5- {[(4- methylpiperazin- 1- yl)amino]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN1CCN(CC1)N/C=C/1\C(=O)N=C(N(C1=O)CCC1=CCCCC1)S

STL044860
Synonyms: 2- (3,4- dimethoxybenzyl)- 5,5,7- trimethyl- 5,6- dihydro- 2H- 1,2,4- triazepine- 3- thiol
Smiles: COc1cc(ccc1OC)CN1N=C(C)CC(N=C1S)(C)C

STL044864
Synonyms: ethyl6- ({2- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (2- ethoxyphenyl)- 2- hydroxy- 3,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1C(=NC(=C(C1c1ccccc1OCC)C#N)SCC(=O)Nc1cc(OC)c(cc1OC)Cl)O

STL044891
Synonyms: 3- fluoro- N- [(4E)- 2- (pyridin- 4- yl)quinazolin- 4(3H)- ylidene]aniline
Smiles: Fc1cccc(c1)/N=c\1/[nH]c(nc2c1cccc2)c1ccncc1

STL044893
Synonyms: (5E)- 5- (2- oxo- 2- phenylethylidene)- 2- sulfanyl- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: O=C(c1ccccc1)/C=C\1/N=C(NC1=O)S

STL044899
Synonyms: 4- {3- [(1R,2R)- 2- phenylcyclopropyl]- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)n1c(n[nH]c1=S)[C@@H]1C[C@H]1c1ccccc1

STL044902
Synonyms: 2,4- dichloro- 6- {[(1- methyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: Clc1cc(CNc2[nH+]c3c(n2C)cccc3)c(c(c1)Cl)[O-]

STL044903
Synonyms: 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5- [{1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 4,6- dihydroxy- 2- thioxo- 1,2- dihydropyrimidin- 5- yl}(4- methoxy- 3- {[2- (pyridin- 3- yl)piperidinium- 1- yl]methyl}phenyl)methyl]- 4- hydroxy- 6-
Smiles: COc1ccc(cc1C[NH+]1CCCCC1c1cccnc1)C(c1c(O)nc(n(c1=O)CCC1=CCCCC1)[S-])c1c(O)nc(=S)n(c1O)CCC1=CCCCC1

STL044912
Synonyms: 7- (4- chlorophenyl)- 6,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 5(3H)- one
Smiles: O=C1CC(c2ccc(cc2)Cl)n2c(=N1)[nH]cn2

STL044915
Synonyms: 2- {[4- (1,3- benzodioxol- 5- yl)- 3- cyano- 6- hydroxy- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (4- bromophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)N=C(CC1c1ccc2c(c1)OCO2)O

STL044918
Synonyms: (5E)- 6- hydroxy- 2- sulfanyl- 5- (2,3,4- trimethoxybenzylidene)pyrimidin- 4(5H)- one
Smiles: COc1ccc(c(c1OC)OC)/C=C/1\C(=NC(=NC1=O)S)O

STL044923
Synonyms: 5- (furan- 2- yl)- 4- {[(E)- (4- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccco1

STL044924
Synonyms: 2- {(6Z)- 6- [(4- chlorophenyl)imino]- 4- methyl- 1,6- dihydropyrimidin- 2- yl}phenol
Smiles: Clc1ccc(cc1)/N=c\1/cc(C)nc([nH]1)c1ccccc1O

STL044925
Synonyms: N- [(1Z)- 8,8- dimethyl- 5- (morpholin- 4- yl)- 8,9- dihydro- 6H- pyrano[4,3- d][1,2]thiazolo[5,4- b]pyridin- 1(2H)- ylidene]benzamide
Smiles: O=C(c1ccccc1)/N=c/1\[nH]sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STL044954
Synonyms: 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)c1ccccc1

STL044960
Synonyms: (5E)- 1- ethyl- 5- [(5- nitrothiophen- 2- yl)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCN1C(=NC(=O)/C(=C\c2ccc(s2)[N+](=O)[O-])/C1=O)S

STL044962
Synonyms: 1- [(E)- {2- [(4- benzylpiperazin- 1- ium- 1- yl)acetyl]hydrazinylidene}methyl]naphthalen- 2- olate
Smiles: O=C(C[NH+]1CCN(CC1)Cc1ccccc1)N/N=C/c1c([O-])ccc2c1cccc2

STL044964
Synonyms: (6Z)- 6- [(2E)- (2,5- dimethoxybenzylidene)hydrazinylidene]- 5,6- dihydro[1,2,4]triazolo[3,4- a]phthalazine
Smiles: COc1ccc(cc1/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2)OC

STL044966
Synonyms: 1- (4- {[(2E)- 4- hydroxy- 1,3- thiazol- 2(5H)- ylidene]amino}phenyl)ethanone
Smiles: CC(=O)c1ccc(cc1)/N=C\1/SCC(=N1)O

STL044969
Synonyms: propyl{[4- (3- bromo- 4- hydroxy- 5- methoxyphenyl)- 3- cyano- 6- hydroxy- 4,5- dihydropyridin- 2- yl]sulfanyl}acetate
Smiles: CCCOC(=O)CSC1=C(C#N)C(CC(=N1)O)c1cc(Br)c(c(c1)OC)O

STL044971
Synonyms: 4- chloro- N- (2,4- dimethylphenyl)- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: Cc1ccc(c(c1)C)N(C(=O)c1ccc(cc1)Cl)Cc1cc2cccc(c2[nH]c1=O)C

STL044972
Synonyms: (5E)- 5- (3,4- dimethoxybenzylidene)- 6- hydroxy- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: COc1ccc(cc1OC)/C=C/1\C(=NC(=NC1=O)S)O

STL044986
Synonyms: (5Z)- 6- hydroxy- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C\c2cccn2C)/C(=N1)O

STK936897
Synonyms: 2- (3,5- dimethyl- 1,2- oxazol- 4- yl)- N- (4- fluorophenyl)acetamide
Smiles: O=C(Cc1c(C)noc1C)Nc1ccc(cc1)F

STK940009
Synonyms: 3- amino- 1- (pyrrolidin- 1- yl)propan- 1- one
Smiles: NCCC(=O)N1CCCC1

STK942247
Synonyms: 3- amino- 1- (4- phenylpiperazin- 1- yl)propan- 1- one
Smiles: NCCC(=O)N1CCN(CC1)c1ccccc1

STK942944
Synonyms: 1- (1H- indol- 2- yl)ethanone
Smiles: CC(=O)c1cc2c([nH]1)cccc2

STK943379
Synonyms: [(3,4- dichlorophenyl)sulfonyl]acetonitrile
Smiles: N#CCS(=O)(=O)c1ccc(c(c1)Cl)Cl

STL008905
Synonyms: [3- (4- methoxyphenyl)- 1,2,4- oxadiazol- 5- yl]acetonitrile
Smiles: N#CCc1onc(n1)c1ccc(cc1)OC

STL044997
Synonyms: 3- [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (3- fluorophenyl)- 4,5- dioxopyrrolidin- 1- yl]propanoicacid
Smiles: OC(=O)CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1cccc(c1)F

STL045007
Synonyms: N- (2- hydroxyethyl)- 4- {[(4- hydroxy- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]methyl}benzamide
Smiles: OCCNC(=O)c1ccc(cc1)CSc1nc(O)c2c(n1)sc1c2CCCC1

STL045009
Synonyms: 2,4- dibromo- 6- {[(1- butyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: CCCCn1c(NCc2cc(Br)cc(c2[O-])Br)[nH+]c2c1cccc2

STL045021
Synonyms: N- [(2Z,5Z)- 4- hydroxy- 5- (5- methoxy- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 1,3- thiazol- 2(5H)- ylidene]- 4- methylbenzenesulfonamide
Smiles: COc1ccc2c(c1)/C(=C\1/S/C(=N\S(=O)(=O)c3ccc(cc3)C)/N=C1O)/C(=O)N2

STL045034
Synonyms: N- (4- chlorobenzyl)- 2,4- dihydroxy- 5,6,7,8- tetrahydroquinoline- 3- carboxamide
Smiles: Clc1ccc(cc1)CNC(=O)c1c(O)nc2c(c1O)CCCC2

STL045048
Synonyms: (3Z)- 3- [(2E)- (thiophen- 2- ylmethylidene)hydrazinylidene]- 4,5- dihydro- 3H- [1,2,4]triazino[5,6- b]indole
Smiles: c1csc(c1)/C=N/N=c/1\nnc2c([nH]1)[nH]c1c2cccc1

STL045079
Synonyms: 5- (1H- pyrazol- 2- ium- 1- ylmethyl)furan- 2- carboxylate
Smiles: [O-]C(=O)c1ccc(o1)Cn1ccc[nH+]1

STL045082
Synonyms: 9- (methylsulfanyl)- 5H- spiro[benzo[h][1,2,4]triazolo[3,4- b]quinazoline- 6,1'- cyclohexan]- 7(11H)- one
Smiles: CSc1n[nH]c2n1c(=O)c1c(n2)c2ccccc2CC21CCCCC2

STL045097
Synonyms: (E)- [2- (3- bromophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene][5- (methoxycarbonyl)- 2,4- dimethyl- 1H- pyrrol- 3- yl]methanolate
Smiles: COC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)Cc1ccc[nH+]c1)/[O-])C

STL045106
Synonyms: 8- amino- 6- hydroxy- 3- methyl- 7- (naphthalen- 1- ylmethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1n(Cc1cccc3c1cccc3)c(n2)N)C

STL045110
Synonyms: 4- chloro- N- [(2Z)- 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)quinoxalin- 2(1H)- ylidene]aniline
Smiles: Clc1ccc(cc1)/N=c/1\[nH]c2ccccc2nc1n1nc(cc1C)C

STL045118
Synonyms: N- (5,7- diphenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)butanamide
Smiles: CCCC(=O)Nc1nn2c(=NC(=CC2c2ccccc2)c2ccccc2)[nH]1

STL045120
Synonyms: N- [2- hydroxy- 5- oxo- 1- (3- phenylpropyl)- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]furan- 2- carboxamide
Smiles: OC1=NC(C(=O)N1CCCc1ccccc1)(NC(=O)c1ccco1)C(F)(F)F

STL045122
Synonyms: 4- [(5,7- diphenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)amino]- 4- oxobutanoicacid
Smiles: O=C(Nc1nn2c(=NC(=CC2c2ccccc2)c2ccccc2)[nH]1)CCC(=O)O

STL045124
Synonyms: N'- {(E)- [4,6- dioxo- 1- (prop- 2- en- 1- yl)- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}benzohydrazide
Smiles: C=CCN1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2)/C1=O)S

STL045125
Synonyms: 2- {[(2E)- 6- ethoxy- 4- methylquinazolin- 2(3H)- ylidene]amino}- 1- methylquinazolin- 4(1H)- one
Smiles: CCOc1ccc2c(c1)c(C)[nH]/c(=N\c1nc(=O)c3c(n1C)cccc3)/n2

STL045127
Synonyms: (6Z)- 6- {(2E)- [(3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]hydrazinylidene}- 5,6- dihydro[1,2,4]triazolo[3,4- a]phthalazine
Smiles: Cc1nn(c(c1/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2)C)c1ccccc1

STL045129
Synonyms: 4- [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (2,4- dimethoxyphenyl)- 4,5- dioxopyrrolidin- 1- yl]butanoicacid
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCCC(=O)O

STL045132
Synonyms: (E)- (3- methoxyphenyl)[2- (5- methylfuran- 2- yl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)Cc1ccc[nH+]c1)/[O-]

STL045150
Synonyms: 1- (4- methoxyphenyl)- 3- [(2Z)- 5- {[5- methyl- 2- (propan- 2- yl)phenoxy]methyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: COc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)COc1cc(C)ccc1C(C)C

STL045157
Synonyms: 2- [(5- ethyl- 4- methyl- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]- N- [1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethyl]acetamide
Smiles: CCc1c(C)nc([nH]c1=O)SCC(=O)NC(C12CC3CC(C2)CC(C1)C3)C

STL045158
Synonyms: (E)- [4,5- dioxo- 2- phenyl- 1- (pyrimidin- 1- ium- 2- yl)pyrrolidin- 3- ylidene](4- fluorophenyl)methanolate
Smiles: Fc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)c1nccc[nH+]1)/[O-]

STL045165
Synonyms: (2Z)- 2- [(2E)- (2,3- dimethoxybenzylidene)hydrazinylidene]- 4- methyl- 1,2- dihydroquinoline
Smiles: COc1c(cccc1OC)/C=N/N=c\1/cc(C)c2c([nH]1)cccc2

STL045170
Synonyms: (2- oxo- 1,2- dihydroquinolin- 3- yl)methyl2- fluorobenzoate
Smiles: O=C(c1ccccc1F)OCc1cc2ccccc2[nH]c1=O

STL045173
Synonyms: 3- [(ethylamino)methyl]quinolin- 2(1H)- one
Smiles: CCNCc1cc2ccccc2[nH]c1=O

STL045179
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- (thiophen- 2- yl)pyrrolidin- 3- ylidene}(phenyl)methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccccc2)/[O-])/C(N1CCCn1c[nH+]cc1)c1cccs1

STL045189
Synonyms: 1- (4- fluorophenyl)- 4- hydroxy- 7- (thiophen- 2- yl)- 5,5- bis(trifluoromethyl)- 5,8- dihydropyrimido[4,5- d]pyrimidin- 2(1H)- one
Smiles: Fc1ccc(cc1)n1c(=O)nc(c2c1NC(=NC2(C(F)(F)F)C(F)(F)F)c1cccs1)O

STL045194
Synonyms: (E)- {1- [3- (dimethylammonio)propyl]- 2- (4- methoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}[5- (methoxycarbonyl)- 2,4- dimethyl- 1H- pyrrol- 3- yl]methanolate
Smiles: COc1ccc(cc1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1c(C)[nH]c(c1C)C(=O)OC)/[O-]

STL045208
Synonyms: N- (biphenyl- 4- yl)- 4- methyl- 1- (3- methylphenyl)- 4,7- dihydro- 1H- pyrazolo[3,4- d]pyrimidin- 4- amine
Smiles: Cc1cccc(c1)n1ncc2c1NC=NC2(C)Nc1ccc(cc1)c1ccccc1

STL045219
Synonyms: 3- {(3E)- 2- (3- fluorophenyl)- 3- [(2E)- 1- hydroxy- 3- phenylprop- 2- en- 1- ylidene]- 4,5- dioxopyrrolidin- 1- yl}benzoicacid
Smiles: Fc1cccc(c1)C1N(c2cccc(c2)C(=O)O)C(=O)C(=O)/C/1=C(\C=C\c1ccccc1)/O

STL045221
Synonyms: N'- {(E)- [1- (4- ethoxyphenyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 2- hydroxybenzohydrazide
Smiles: CCOc1ccc(cc1)N1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2O)/C1=O)S

STL045225
Synonyms: (E)- furan- 2- yl[2- (4- methylphenyl)- 4,5- dioxo- 1- (pyrimidin- 1- ium- 2- yl)pyrrolidin- 3- ylidene]methanolate
Smiles: Cc1ccc(cc1)C1/C(=C(/c2ccco2)\[O-])/C(=O)C(=O)N1c1nccc[nH+]1

STL045234
Synonyms: N'- (benzo[cd]indol- 2- yl)- 2- chlorobenzohydrazide
Smiles: O=C(c1ccccc1Cl)NNC1=Nc2c3c1cccc3ccc2

STL045243
Synonyms: 2- {[3- cyano- 6- hydroxy- 4- (2- methoxyphenyl)- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)F)N=C(CC1c1ccccc1OC)O

STL045248
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 5- (3- ethoxy- 4- hydroxyphenyl)- 1- (tetrahydrofuran- 2- ylmethyl)pyrrolidine- 2,3- dione
Smiles: CCOc1cc(ccc1O)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CC1CCCO1

STL045252
Synonyms: 6- [1,3- benzodioxol- 5- yl(5- hydroxy- 7- oxo- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyrimidin- 6- yl)methyl]- 7- hydroxy- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidin- 5- one
Smiles: O=c1nc2SCCn2c(c1C(c1c(O)nc2n(c1=O)CCS2)c1ccc2c(c1)OCO2)O

STL045270
Synonyms: 4- {[(E)- (4- chlorophenyl)methylidene]amino}- 5- (pyridin- 4- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccncc1

STL045271
Synonyms: 4- [(E)- {2- [(4- benzylpiperazin- 1- ium- 1- yl)acetyl]hydrazinylidene}methyl]- 2- methoxyphenolate
Smiles: COc1cc(/C=N/NC(=O)C[NH+]2CCN(CC2)Cc2ccccc2)ccc1[O-]

STL045275
Synonyms: N- (2,3- dimethylphenyl)- 2- hydroxy- 6- (4- methoxyphenyl)- 4- methyl- 1,6- dihydropyrimidine- 5- carboxamide
Smiles: COc1ccc(cc1)C1NC(=NC(=C1C(=O)Nc1cccc(c1C)C)C)O

STL045283
Synonyms: N- {N'- [4- (benzyloxy)phenyl]- N- (4,6- dimethylpyrimidin- 2- yl)carbamimidoyl}- 2- phenylbutanamide
Smiles: CCC(C(=O)N/C(=N\c1ccc(cc1)OCc1ccccc1)/Nc1nc(C)cc(n1)C)c1ccccc1

STL045285
Synonyms: 6- hydroxy- 8- [(4- methoxybenzyl)amino]- 3- methyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: C=CCn1c(NCc2ccc(cc2)OC)nc2c1c(O)nc(=O)n2C

STL045292
Synonyms: (5E)- 5- ({[2- (dimethylamino)ethyl]amino}methylidene)- 1- (3- methylphenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN(CCN/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C)S)C

STL045298
Synonyms: (4E)- 1- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 5- (4- hydroxy- 3- methoxyphenyl)- 4- [hydroxy(4- methoxyphenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)O)c1nc(c(s1)C)C)/O

STL045339
Synonyms: 4- iodo- N- [(4E)- 1- methyl- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]aniline
Smiles: Ic1ccc(cc1)/N=c\1/nc[nH]c2c1cnn2C

STL045346
Synonyms: 2- [(pyridinium- 2- ylamino)methyl]phenolate
Smiles: [O-]c1ccccc1CNc1cccc[nH+]1

STL045372
Synonyms: N'- [(E)- (4- fluorophenyl)methylidene]- 2,4- dihydroxy- 5,6,7,8- tetrahydroquinoline- 3- carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1c(O)nc2c(c1O)CCCC2

STL045380
Synonyms: 7- (3,4- dimethoxyphenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: COc1cc(ccc1OC)C1C=C(N=c2n1nc[nH]2)c1ccccc1

STL045382
Synonyms: 6- ethyl- 6- methyl- 6,11- dihydrobenzo[h]tetrazolo[5,1- b]quinazolin- 7(5H)- one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n1c(n2)[nH]nn1

STL045395
Synonyms: 6- hydroxy- 8- [(2- hydroxyethyl)amino]- 3- methyl- 7- (naphthalen- 1- ylmethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCNc1nc2c(n1Cc1cccc3c1cccc3)c(O)nc(=O)n2C

STL045409
Synonyms: 3- [(Z)- (5- hydroxy- 2- sulfanyl- 4H- imidazol- 4- ylidene)methyl]- 7- methoxyquinolin- 2(1H)- one
Smiles: COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C/1\N=C(N=C1O)S

STL045410
Synonyms: (E)- [2- (4- methoxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- yl)pyrrolidin- 3- ylidene](phenyl)methanolate
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1c1ccc[nH+]c1

STL045412
Synonyms: methyl3- {[(1- hexyl- 2- hydroxy- 4- oxo- 1,4- dihydroquinolin- 3- yl)carbonyl]amino}thiophene- 2- carboxylate
Smiles: CCCCCCn1c(O)c(C(=O)Nc2ccsc2C(=O)OC)c(=O)c2c1cccc2

STL045413
Synonyms: 2- {[2- (dimethylamino)ethyl]sulfanyl}- 5- phenylpyrimidine- 4,6- diol
Smiles: CN(CCSc1nc(O)c(c(n1)O)c1ccccc1)C

STL045417
Synonyms: N- [(2Z)- 6- bromo- 4- phenylquinazolin- 2(1H)- ylidene]- 1,3- benzothiazol- 2- amine
Smiles: Brc1ccc2c(c1)c(n/c(=N\c1nc3c(s1)cccc3)/[nH]2)c1ccccc1

STL045423
Synonyms: 6- hydroxy- N- [(2E)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxo- 1,2- dihydro- 4H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: Cc1n[nH]/c(=N\C(=O)c2c(O)c3cccc4c3n(c2=O)CC4)/s1

STL045430
Synonyms: (5Z)- 5- (furan- 2- ylmethylidene)- 1- phenyl- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: SC1=NC(=O)/C(=C/c2ccco2)/C(=O)N1c1ccccc1

STL045437
Synonyms: 5- (propan- 2- yl)- N'- [(1Z)- 1- (thiophen- 2- yl)ethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)C(C)C)N/N=C(\c1cccs1)/C

STL045444
Synonyms: (5Z)- 3- (3- chloro- 4- methylphenyl)- 5- [4- (diethylamino)benzylidene]- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCN(c1ccc(cc1)/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)Cl)C)O)CC

STL045447
Synonyms: 2- hydroxy- N'- [(2Z)- 4- oxo- 4- (pyridin- 3- yl)butan- 2- ylidene]benzohydrazide
Smiles: C/C(=N/NC(=O)c1ccccc1O)/CC(=O)c1cccnc1

STL045467
Synonyms: 7- benzyl- 2- (morpholin- 4- yl)- 7H- purin- 6- ol
Smiles: Oc1nc(nc2c1n(cn2)Cc1ccccc1)N1CCOCC1

STL045470
Synonyms: 4- {(E)- [2- ({1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4,5- dihydro- 1,3- thiazol- 2- ylsulfanyl)methyl]- 1H- 1,2,3- triazol- 4- yl}carbonyl)hydrazinylidene]methyl}- 2- ethoxyphenyl4- fluorobenzoate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CSC2=NCCS2)c2nonc2N)ccc1OC(=O)c1ccc(cc1)F

STL045476
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]pyridine- 3- carboxamide
Smiles: Fc1ccc(cc1)n1c(=O)nc(c2c1NC(=O)C2(NC(=O)c1cccnc1)C(F)(F)F)O

STL045488
Synonyms: 2- ethyl- N- [(7E)- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(4H)- ylidene]aniline
Smiles: CCc1ccccc1/N=c/1\cc(C)[nH]c2n1ncn2

STL045501
Synonyms: 4- {[5- (4- chlorophenyl)- 7- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]amino}- 4- oxobutanoicacid
Smiles: O=C(Nc1nn2c(=NC(=CC2c2ccccc2)c2ccc(cc2)Cl)[nH]1)CCC(=O)O

STL045506
Synonyms: 6- amino- 3- {[(4- methylphenyl)sulfanyl]methyl}- 4- (pyridin- 3- yl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccnc1)c(CSc1ccc(cc1)C)n[nH]2

STL045513
Synonyms: 2- amino- 8- (morpholin- 4- yl)- 7H- purin- 6- ol
Smiles: Nc1nc2nc([nH]c2c(n1)O)N1CCOCC1

STL045519
Synonyms: (E)- {2- (5- methylfuran- 2- yl)- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}(phenyl)methanolate
Smiles: Cc1ccc(o1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccccc1)/[O-]

STL045536
Synonyms: (5E)- 5- {[(1- benzylpiperidin- 4- yl)amino]methylidene}- 6- hydroxy- 3- methylpyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C(=O)N1C

STL045546
Synonyms: (6- bromo- 5- methyl- 7- oxo- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)aceticacid
Smiles: OC(=O)Cc1nn2c([nH]1)nc(c(c2=O)Br)C

STL045554
Synonyms: (5E)- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 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)CCC1=CCCCC1

STL045557
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- [4- (propan- 2- yl)phenyl]pyrrolidin- 3- ylidene}(4- methylphenyl)methanolate
Smiles: Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CCCn1cc[nH+]c1)/[O-]

STL045560
Synonyms: 1,1- dimethyl- 3- (2H- tetrazol- 5- yl)urea
Smiles: O=C(N(C)C)Nc1n[nH]nn1

STL045562
Synonyms: 7- [4- ({[3- (2,6- dichlorophenyl)- 5- methyl- 1,2- oxazol- 4- yl]carbonyl}carbamothioyl)piperazin- 1- ium- 1- yl]- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CCn1cc(C(=O)[O-])c(=O)c2c1cc(c(c2)F)[NH+]1CCN(CC1)C(=S)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl

STL045573
Synonyms: 3- {(3E)- 2- (2- fluorophenyl)- 3- [(2E)- 1- hydroxy- 3- phenylprop- 2- en- 1- ylidene]- 4,5- dioxopyrrolidin- 1- yl}benzoicacid
Smiles: OC(=O)c1cccc(c1)N1C(=O)C(=O)/C(=C(\C=C\c2ccccc2)/O)/C1c1ccccc1F

STL045584
Synonyms: 3- hydroxy- 4- [(E)- (2- {[4- (4- methylbenzyl)piperazin- 1- ium- 1- yl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: Cc1ccc(cc1)CN1CC[NH+](CC1)CC(=O)N/N=C/c1ccc(cc1O)[O-]

STL045585
Synonyms: [(4,6- dihydroxy- 5- propylpyrimidin- 2- yl)sulfanyl]aceticacid
Smiles: CCCc1c(O)nc(nc1O)SCC(=O)O

STL045593
Synonyms: 5- (4- chlorophenyl)- 7- (2,4- dichlorophenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Clc1ccc(cc1)C1=CC(n2c(=N1)[nH]cn2)c1ccc(cc1Cl)Cl

STL045595
Synonyms: N,N'- (2- phenyl- 2,4- dihydro- 3H- 1,2,4- triazol- 5- yl- 3- ylidene)diacetamide
Smiles: CC(=O)Nc1nn(/c(=N/C(=O)C)/[nH]1)c1ccccc1

STL045604
Synonyms: 3- (3- hydroxy- 5- methyl- 1H- pyrazol- 4- yl)- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}propanehydrazide
Smiles: O=C(CCc1c(C)[nH]nc1O)N/N=C/c1ccc(cc1)C(C)C

STL045607
Synonyms: N- [(2E)- 3- (3,4- dimethoxyphenyl)prop- 2- enoyl]morpholine- 4- carbimidothioicacid
Smiles: COc1cc(/C=C/C(=O)/N=C(/N2CCOCC2)\S)ccc1OC

STL045609
Synonyms: 5- {[5- (4- chlorophenyl)- 7- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]amino}- 5- oxopentanoicacid
Smiles: O=C(Nc1nn2c(=NC(=CC2c2ccccc2)c2ccc(cc2)Cl)[nH]1)CCCC(=O)O

STL045612
Synonyms: 7- benzyl- 6- hydroxy- 3,4- dihydro- 2H,8H- pyrimido[2,1- b][1,3]thiazin- 8- one
Smiles: Oc1n2CCCSc2nc(=O)c1Cc1ccccc1

STL045632
Synonyms: 3- {(3E)- 2- (2- fluorophenyl)- 3- [hydroxy(phenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}benzoicacid
Smiles: OC(=O)c1cccc(c1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1F

STL045646
Synonyms: 2- (4- methoxyphenyl)- 4- phenyl- 4,10- dihydropyrimido[1,2- a]benzimidazole
Smiles: COc1ccc(cc1)C1=CC(n2c(=N1)[nH]c1c2cccc1)c1ccccc1

STL045658
Synonyms: 3- [6- hydroxy- 3- methyl- 2- oxo- 8- (piperidin- 1- yl)- 2,3- dihydro- 7H- purin- 7- yl]propanoicacid
Smiles: OC(=O)CCn1c(nc2c1c(O)nc(=O)n2C)N1CCCCC1

STL045668
Synonyms: methyl(2- hydroxy- 6- methyl- 4- phenylquinolin- 3- yl)acetate
Smiles: COC(=O)Cc1c(O)nc2c(c1c1ccccc1)cc(cc2)C

STL045683
Synonyms: 2,6- dihydroxy- 5- [(2E)- 3- phenylprop- 2- en- 1- yl]- 5- [2- (pyridin- 4- yl)ethyl]pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)C(C(=N1)O)(C/C=C/c1ccccc1)CCc1ccncc1

STL045688
Synonyms: 4- [3- (4- bromophenyl)- 3- oxo- 2- phenylpropyl]morpholin- 4- ium
Smiles: Brc1ccc(cc1)C(=O)C(c1ccccc1)C[NH+]1CCOCC1

STL045694
Synonyms: 4- {(4E)- 4- [(2- hydroxyphenyl)imino]- 3,4- dihydrophthalazin- 1- yl}- N,N- dimethylbenzamide
Smiles: CN(C(=O)c1ccc(cc1)c1n[nH]/c(=N/c2ccccc2O)/c2c1cccc2)C

STL045702
Synonyms: (5Z)- 5- ({[2- (dimethylamino)ethyl]amino}methylidene)- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: CN(CCN/C=C\1/C(=NC(=NC1=O)O)O)C

STL045711
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (thiophen- 2- yl)pyrrolidin- 3- ylidene](4- propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)Cc1ccc[nH+]c1)/[O-]

STL045717
Synonyms: 4- {(1Z)- 1- [2- (pyridinium- 3- ylcarbonyl)hydrazinylidene]propyl}phenolate
Smiles: CC/C(=N/NC(=O)c1ccc[nH+]c1)/c1ccc(cc1)[O-]

STL045718
Synonyms: (E)- 1- benzofuran- 2- yl{1- [2- (diethylammonio)ethyl]- 2- (2- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: CC[NH+](CCN1C(c2ccccc2F)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)CC

STL045723
Synonyms: 4- (2,4- dichlorophenyl)- 6- hydroxy- 2- (propylsulfanyl)- 4,5- dihydropyridine- 3- carbonitrile
Smiles: CCCSC1=C(C#N)C(CC(=N1)O)c1ccc(cc1Cl)Cl

STL045725
Synonyms: methyl4- {[(1Z)- 4- {3- [(1- hydroxy- 2- methylpropan- 2- yl)sulfamoyl]- 4- methylphenyl}phthalazin- 1(2H)- ylidene]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)/N=c/1\[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NC(CO)(C)C)C

STL045756
Synonyms: (4- {(E)- [2- hydroxy- 4,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}phenoxy)aceticacid
Smiles: C=CCN1C(=NC(=O)/C(=C\c2ccc(cc2)OCC(=O)O)/C1=O)O

STL045763
Synonyms: (3E)- 4- (1,3- benzodioxol- 5- yl)- 1- (5- bromo- 2,3- dihydroxy- 3H- indol- 3- yl)but- 3- en- 2- one
Smiles: O=C(CC1(O)C(=Nc2c1cc(Br)cc2)O)/C=C/c1ccc2c(c1)OCO2

STL045770
Synonyms: N- [(2E)- 5- {2- [(2E)- 2- (4- hydroxybenzylidene)hydrazinyl]- 2- oxoethyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- methylbenzamide
Smiles: O=C(Cc1n[nH]/c(=N\C(=O)c2ccccc2C)/s1)N/N=C/c1ccc(cc1)O

STL045776
Synonyms: N- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]- 4- nitro- N- phenylbenzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1)CN1C(=NC(C1=O)(C)C)O

STL045790
Synonyms: methyl(2Z)- [(2Z)- 4- hydroxy- 2- {[(4- methylphenyl)carbonyl]imino}- 1,3- thiazol- 5(2H)- ylidene]ethanoate
Smiles: COC(=O)/C=C/1\S/C(=N\C(=O)c2ccc(cc2)C)/N=C1O

STL045797
Synonyms: 1- (2- methylphenyl)- 3- [(2E)- 5- (thiophen- 2- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: O=C(Nc1ccccc1C)/N=c/1\[nH]nc(s1)c1cccs1

STL045815
Synonyms: 3- hydroxy- 1- oxo- N- (4- oxo- 2- pentylquinazolin- 3(4H)- yl)- 6,7- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 2- carboxamide
Smiles: CCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(=O)c2cccc3c2n(c1O)CCC3

STL045852
Synonyms: N- [(2Z)- 4- (3- bromo- 4- methoxyphenyl)- 1,3- thiazol- 2(3H)- ylidene]- 3- methylbenzamide
Smiles: COc1ccc(cc1Br)c1cs/c(=N\C(=O)c2cccc(c2)C)/[nH]1

STL045853
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}(thiophen- 2- yl)methanolate
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL045854
Synonyms: (5Z)- 3- benzyl- 5- {[1- (3- chloropropyl)- 2,3- dihydro- 1H- indol- 5- yl]methylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O

STL045860
Synonyms: methyl3- {[(2- hydroxy- 1- nonyl- 4- oxo- 1,4- dihydroquinolin- 3- yl)carbonyl]amino}thiophene- 2- carboxylate
Smiles: CCCCCCCCCn1c(O)c(C(=O)Nc2ccsc2C(=O)OC)c(=O)c2c1cccc2

STL045871
Synonyms: {2- [(E)- (2- {[4- (4- methylbenzyl)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)C

STL045880
Synonyms: 4- hydroxy- 1- (4- methylphenyl)- 7- (pyridin- 3- yl)- 5,5- bis(trifluoromethyl)- 5,8- dihydropyrimido[4,5- d]pyrimidin- 2(1H)- one
Smiles: Cc1ccc(cc1)n1c(=O)nc(c2c1NC(=NC2(C(F)(F)F)C(F)(F)F)c1cccnc1)O

STL045884
Synonyms: 4- ({(E)- [4- (diethylamino)- 2- hydroxyphenyl]methylidene}amino)- 5- (phenoxymethyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCN(c1ccc(c(c1)O)/C=N/n1c(COc2ccccc2)n[nH]c1=S)CC

STL045888
Synonyms: 2,4- dihydroxy- N'- [(E)- pyridin- 2- ylmethylidene]- 5,6,7,8- tetrahydroquinoline- 3- carbohydrazide
Smiles: O=C(c1c(O)nc2c(c1O)CCCC2)N/N=C/c1ccccn1

STL045900
Synonyms: (1E)- 1- [(3- chloro- 4- methylphenyl)imino]- 2- ethyl- 3- methyl- 1,5- dihydropyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(/c/1=N/c1ccc(c(c1)Cl)C)c1ccccc1[nH]2

STL045903
Synonyms: 5- ammonio- 1H- 1,2,4- triazole- 3- carboxylate
Smiles: [O-]C(=O)c1n[nH]c(n1)[NH3+]

STL045910
Synonyms: (5E)- 5- (furan- 2- ylmethylidene)- 1- (2- methylphenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccco1)c1ccccc1C

STL045913
Synonyms: (5Z)- 1- (2- fluorophenyl)- 2- sulfanyl- 5- (3,4,5- trimethoxybenzylidene)pyrimidine- 4,6(1H,5H)- dione
Smiles: COc1c(OC)cc(cc1OC)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1F)S

STL045917
Synonyms: N- [(2Z)- 4- (3- bromo- 4- methoxyphenyl)- 1,3- thiazol- 2(3H)- ylidene]- 3- propoxybenzamide
Smiles: CCCOc1cccc(c1)C(=O)/N=c/1\scc([nH]1)c1ccc(c(c1)Br)OC

STL045921
Synonyms: 6- hydroxy- 8- [(3- methoxypropyl)amino]- 3- methyl- 7- (3- phenylpropyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: COCCCNc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

STL045922
Synonyms: (5E)- 5- {[(5- chloro- 2- phenoxyphenyl)amino]methylidene}- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C/Nc2cc(Cl)ccc2Oc2ccccc2)/C(=N1)O

STL045928
Synonyms: (E)- {1- [2- (dimethylammonio)ethyl]- 4,5- dioxo- 2- (3- phenoxyphenyl)pyrrolidin- 3- ylidene}(4- methoxy- 3- methylphenyl)methanolate
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)CC[NH+](C)C)/[O-]

STL045930
Synonyms: 1- (1,3- benzodioxol- 5- yl)- 2- (4- bromophenyl)- 2- hydroxy- 1,2,3,5,6,7,8,9- octahydroimidazo[1,2- a]azepin- 4- ium
Smiles: Brc1ccc(cc1)C1(O)C[N+]2=C(N1c1ccc3c(c1)OCO3)CCCCC2

STL045932
Synonyms: N- [(E)- 2- (2- chlorophenyl)- 1- (5- sulfanyl- 4H- 1,2,4- triazol- 3- yl)ethenyl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)N/C(=C/c1ccccc1Cl)/c1nnc([nH]1)S

STL045938
Synonyms: N- {(E)- amino[(2E)- 1,3- benzoxazol- 2(3H)- ylideneamino]methylidene}- 2- [(phenylcarbonyl)amino]benzamide
Smiles: N/C(=N\C(=O)c1ccccc1NC(=O)c1ccccc1)/N=c\1/oc2c([nH]1)cccc2

STL045942
Synonyms: N- [(2E)- 6- ethoxy- 4- methylquinazolin- 2(1H)- ylidene]- 4- methyl- 6- (trifluoromethyl)pyrimidin- 2- amine
Smiles: CCOc1ccc2c(c1)c(C)n/c(=N/c1nc(C)cc(n1)C(F)(F)F)/[nH]2

STL045945
Synonyms: 4- {[(E)- (1- methyl- 1H- pyrrol- 2- yl)methylidene]amino}- 5- (pyridin- 4- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cn1cccc1/C=N/n1c(=S)[nH]nc1c1ccncc1

STL045959
Synonyms: 5- [(3- chloro- 4- methoxybenzyl)sulfanyl]- 1H- 1,2,4- triazole
Smiles: COc1ccc(cc1Cl)CSc1ncn[nH]1

STL045968
Synonyms: 2- [(7- oxo- 7,11- dihydro- 5H- spiro[benzo[h][1,2,4]triazolo[3,4- b]quinazoline- 6,1'- cyclohexan]- 9- yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1n[nH]c2n1c(=O)c1c(n2)c2ccccc2CC21CCCCC2

STL045970
Synonyms: 4- {(E)- [2- ({4- [(4- methylphenyl)sulfonyl]piperazin- 1- ium- 1- yl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: O=C(C[NH+]1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)N/N=C/c1ccc(cc1)C(=O)[O-]

STL045971
Synonyms: 6- {[(4- chlorophenyl)sulfanyl]methyl}- 2- {[(2Z)- 6- methoxy- 4- methylquinazolin- 2(3H)- ylidene]amino}pyrimidin- 4(1H)- one
Smiles: COc1ccc2c(c1)c(C)[nH]/c(=N/c1nc(=O)cc([nH]1)CSc1ccc(cc1)Cl)/n2

STL045972
Synonyms: furan- 2- yl(1H- imidazol- 2- yl)methanone
Smiles: O=C(c1ncc[nH]1)c1ccco1

STL045977
Synonyms: 7- hexyl- 6- hydroxy- 3- methyl- 8- (4- methylpiperidin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCCn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)C

STL045978
Synonyms: N- [(4- fluorophenyl)carbonyl]morpholine- 4- carbimidothioicacid
Smiles: O=C(c1ccc(cc1)F)/N=C(/N1CCOCC1)\S

STL045987
Synonyms: N- butyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]butanamide
Smiles: CCCCN(C(=O)CCC)Cc1cc2ccc(cc2[nH]c1=O)C

STL045988
Synonyms: 2- [(E)- {2- [(4- benzylpiperazin- 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)Cc1ccccc1

STL045999
Synonyms: (5E)- 6- hydroxy- 5- ({[2- (1H- indol- 3- yl)ethyl]amino}methylidene)- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C/NCCc2c[nH]c3c2cccc3)/C(=N1)O

STL046009
Synonyms: 1- cyclopentyl- 4- (4- fluorophenyl)- 7- hydroxy- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: Fc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C1CCCC1)O

STL046029
Synonyms: N- [1- (3,5- dimethoxybenzyl)- 6,6- dimethyl- 2,4- dioxo- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]- 3,4,5- trimethoxybenzamide
Smiles: COc1cc(OC)cc(c1)CN1C2=C(C(C1=O)(NC(=O)c1cc(OC)c(c(c1)OC)OC)C(F)(F)F)C(=O)CC(C2)(C)C

STL046032
Synonyms: (E)- (4- chlorophenyl)[2- (2- fluorophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)Cc1ccc[nH+]c1)/[O-]

STL046037
Synonyms: N,N- dibenzyl- 2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propan- 1- aminium
Smiles: OC(CN1C(=NC(C1=O)(C)C)O)C[NH+](Cc1ccccc1)Cc1ccccc1

STL046043
Synonyms: 6- hydroxy- 3- methyl- 7- (3- methylbutyl)- 8- thioxo- 3,7,8,9- tetrahydro- 2H- purin- 2- one
Smiles: CC(CCn1c(=S)[nH]c2c1c(O)nc(=O)n2C)C

STL046063
Synonyms: (4Z)- 4- [(4- fluorophenyl)imino]- 6- ({[5- (pyridin- 4- yl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}methyl)- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Fc1ccc(cc1)/N=c/1\nc(N)nc([nH]1)CSc1nnc(o1)c1ccncc1

STL046068
Synonyms: N- [4- ({(Z)- [4- hydroxy- 1- (2- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O

STL046073
Synonyms: 5- (4- chlorophenyl)- 4- {[(E)- pyridin- 2- ylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccn1

STL046085
Synonyms: 2- {[(2Z)- 6- ethyl- 4- methylquinazolin- 2(3H)- ylidene]amino}- 6- (methoxymethyl)pyrimidin- 4(1H)- one
Smiles: COCc1cc(=O)nc([nH]1)/N=c/1\nc2ccc(cc2c([nH]1)C)CC

STL046086
Synonyms: (4E)- 4- [(2E)- (2- propoxybenzylidene)hydrazinylidene]- 3,4- dihydropyrimidin- 2(1H)- one
Smiles: CCCOc1ccccc1/C=N/N=c/1\cc[nH]c(=O)[nH]1

STL046089
Synonyms: (3E)- 3- [(2- aminophenyl)imino]- 5- (3,4- dimethoxyphenyl)cyclohex- 1- en- 1- ol
Smiles: COc1cc(ccc1OC)C1CC(=C/C(=N/c2ccccc2N)/C1)O

STL046090
Synonyms: 5- benzyl- 6- hydroxy- 1- (2- methylphenyl)- 2- {[2- (morpholin- 4- yl)- 2- oxoethyl]sulfanyl}pyrimidin- 4(1H)- one
Smiles: O=C(N1CCOCC1)CSc1nc(=O)c(c(n1c1ccccc1C)O)Cc1ccccc1

STL046094
Synonyms: (4E)- 4- [(2E)- (2,4- dimethoxybenzylidene)hydrazinylidene]- 3,4- dihydropyrimidin- 2(1H)- one
Smiles: COc1cc(OC)ccc1/C=N/N=c/1\cc[nH]c(=O)[nH]1

STL046111
Synonyms: 2- (azepan- 1- yl)- 7- benzyl- 7H- purin- 6- ol
Smiles: Oc1nc(nc2c1n(cn2)Cc1ccccc1)N1CCCCCC1

STL046116
Synonyms: 6- ethyl- 6- methyl- 9- (propylsulfanyl)- 6,11- dihydrobenzo[h][1,2,4]triazolo[3,4- b]quinazolin- 7(5H)- one
Smiles: CCCSc1n[nH]c2n1c(=O)c1c(n2)c2ccccc2CC1(C)CC

STL046123
Synonyms: N- [(2E)- 4,6- dimethylquinazolin- 2(1H)- ylidene]- 5- (2- phenylethyl)- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: Cc1ccc2c(c1)c(C)n/c(=N/C1=NCN(CN1)CCc1ccccc1)/[nH]2

STL046130
Synonyms: methyl[(2Z)- 5- (propylsulfanyl)- 1,3- dihydro- 2H- benzimidazol- 2- ylidene]carbamate
Smiles: CCCSc1ccc2c(c1)[nH]/c(=N\C(=O)OC)/[nH]2

STL046140
Synonyms: (E)- {1- [3- (dimethylammonio)propyl]- 4,5- dioxo- 2- (pyridin- 4- yl)pyrrolidin- 3- ylidene}[5- (methoxycarbonyl)- 2,4- dimethyl- 1H- pyrrol- 3- yl]methanolate
Smiles: COC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CCC[NH+](C)C)/[O-])C

STL046142
Synonyms: N- cycloheptyl- 2,4- dihydroxy- 5,6,7,8- tetrahydroquinoline- 3- carboxamide
Smiles: O=C(c1c(O)nc2c(c1O)CCCC2)NC1CCCCCC1

STL046154
Synonyms: 1- (3,5- dichlorophenyl)- 3- [(4- hydroxy- 5- methyl- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]pyrrolidine- 2,5- dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)CC(C1=O)Sc1nc(O)c(c(=O)[nH]1)C

STL046158
Synonyms: 1- (4- chlorophenyl)- 3- [(2Z)- 5- (1- phenoxyethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: Clc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)C(Oc1ccccc1)C

STL046159
Synonyms: 4- phenyl- 2,3- dihydro- 1,5- benzothiazepin- 5- ium- 2- carboxylate
Smiles: [O-]C(=O)C1Sc2ccccc2[NH+]=C(C1)c1ccccc1

STL046168
Synonyms: 1- (3,4- dimethylphenyl)- 3- [(2E)- 5- (phenoxymethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: O=C(/N=c/1\[nH]nc(s1)COc1ccccc1)Nc1ccc(c(c1)C)C

STL046172
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 2- (3- nitrophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(4- propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CCCn1c[nH+]cc1)/[O-]

STL046173
Synonyms: 3- {[(2,4- dimethylphenyl)amino]methyl}- 7- methylquinolin- 2(1H)- one
Smiles: Cc1ccc(c(c1)C)NCc1cc2ccc(cc2[nH]c1=O)C

STL046178
Synonyms: (3Z)- 3- {2- [(3- methoxyphenyl)amino]- 4- oxo- 1,3- thiazol- 5(4H)- ylidene}- 1- methyl- 1,3- dihydro- 2H- indol- 2- one
Smiles: COc1cccc(c1)NC1=NC(=O)/C(=C/2\c3ccccc3N(C2=O)C)/S1

STL046180
Synonyms: (2Z)- 6- chloro- 2- {(2E)- [(5- chlorofuran- 2- yl)methylidene]hydrazinylidene}- 4- phenyl- 2,3- dihydroquinazoline
Smiles: Clc1ccc(o1)/C=N/N=c/1\nc2ccc(cc2c([nH]1)c1ccccc1)Cl

STL046181
Synonyms: (3E)- 3- [(2Z)- [1,2,4]triazolo[3,4- a]phthalazin- 6(5H)- ylidenehydrazinylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Nc2c(/C/1=N\N=c\1/[nH]n3cnnc3c3c1cccc3)cccc2

STL046183
Synonyms: 4- [(E)- (2- {[4- (4- methylbenzyl)piperazin- 1- ium- 1- yl]acetyl}hydrazinylidene)methyl]benzoate
Smiles: O=C(C[NH+]1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccc(cc1)C(=O)[O-]

STL046207
Synonyms: (2Z)- 2- (1H- benzimidazol- 2- yl)- 3- hydroxy- 4- ({[(E)- (4- methoxyphenyl)methylidene]amino}oxy)but- 2- enenitrile
Smiles: COc1ccc(cc1)/C=N/OC/C(=C(/c1nc2c([nH]1)cccc2)\C#N)/O

STL046210
Synonyms: 4- amino- 6- propyl- 1,5,6,8- tetrahydro- 2H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine- 2- thione
Smiles: CCCC1OCc2c(C1)c1c(N)nc(=S)[nH]c1s2

STL046215
Synonyms: 1- [(2Z)- 5- (2- ethoxyethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- (4- fluorophenyl)urea
Smiles: CCOCCc1n[nH]/c(=N/C(=O)Nc2ccc(cc2)F)/s1

STL046230
Synonyms: N- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]- 4- methyl- N- (2- nitrophenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc(cc1)C)c1ccccc1[N+](=O)[O-])CN1C(=NC(C1=O)(C)C)O

STL046232
Synonyms: 11- (5- chloro- 3- methyl- 1- phenyl- 1H- pyrazol- 4- yl)- 3,3- dimethyl- 3,4,10,11- tetrahydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: OC1=C2C(=Nc3c(NC2c2c(C)nn(c2Cl)c2ccccc2)cccc3)CC(C1)(C)C

STL046239
Synonyms: (E)- (3- methoxyphenyl)[2- (2- methoxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1OC)Cc1ccc[nH+]c1)/[O-]

STL046246
Synonyms: 4- [1- (4- hydroxybenzyl)- 1H- 3,1- benzimidazol- 3- ium- 2- yl]phenolate
Smiles: [O-]c1ccc(cc1)c1[nH+]c2c(n1Cc1ccc(cc1)O)cccc2

STL046255
Synonyms: (E)- 2,3- dihydro- 1,4- benzodioxin- 6- yl[2- (4- methylphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: Cc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL046261
Synonyms: N- {2- oxo- 1- (4- oxo- 3,4- dihydrophthalazin- 1- yl)- 2- [(2E)- 2- (pyridin- 2- ylmethylidene)hydrazinyl]ethyl}benzamide
Smiles: O=C(c1ccccc1)NC(c1n[nH]c(=O)c2c1cccc2)C(=O)N/N=C/c1ccccn1

STL046268
Synonyms: N- (3- methoxyphenyl)- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]acetamide
Smiles: COc1cccc(c1)N(C(=O)C)Cc1cc2ccc(cc2[nH]c1=O)C

STL046274
Synonyms: (E)- {2- (3- bromophenyl)- 1- [3- (dimethylammonio)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}[5- (ethoxycarbonyl)- 2,4- dimethyl- 1H- pyrrol- 3- yl]methanolate
Smiles: CCOC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)CCC[NH+](C)C)/[O-])C

STL046281
Synonyms: 2- {(4Z)- 4- [(3,5- dichlorophenyl)imino]- 3,4- dihydroquinazolin- 2- yl}phenol
Smiles: Clc1cc(Cl)cc(c1)/N=c/1\[nH]c(nc2c1cccc2)c1ccccc1O

STL046294
Synonyms: 1- [4- fluoro- 3- (pyrrolidin- 1- yl)phenyl]- 1H- tetrazole- 5- thiol
Smiles: Fc1ccc(cc1N1CCCC1)n1nnnc1S

STL046308
Synonyms: [(5Z)- 4- oxo- 5- (pyridinium- 3- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl](phenyl)acetate
Smiles: S=C1S/C(=C\c2ccc[nH+]c2)/C(=O)N1C(c1ccccc1)C(=O)[O-]

STL046312
Synonyms: N- (4- ethoxyphenyl)- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]tetrahydrofuran- 2- carboxamide
Smiles: CCOc1ccc(cc1)N(C(=O)C1CCCO1)Cc1cc2cc(OC)ccc2[nH]c1=O

STL046321
Synonyms: 6- {[4- (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)c1nc2ccccc2c(n1)c1ccccc1

STL046325
Synonyms: (5E)- 5- [({4- [ethyl(2- hydroxyethyl)amino]phenyl}amino)methylidene]- 6- hydroxy- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: OCCN(c1ccc(cc1)N/C=C/1\C(=NC(=NC1=O)S)O)CC

STL046326
Synonyms: 4- chloro- 2- {[(1- propyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}phenolate
Smiles: CCCn1c(NCc2cc(Cl)ccc2[O-])[nH+]c2c1cccc2

STL046339
Synonyms: 4- methoxy- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- phenylbenzamide
Smiles: COc1ccc(cc1)C(=O)N(c1ccccc1)Cc1cc2cccc(c2[nH]c1=O)C

STL046341
Synonyms: 2,2'- (dihydropyrimidinediium- 1,3(2H,4H)- diyldimethanediyl)diphenolate
Smiles: [O-]c1ccccc1C[NH+]1CCC[NH+](C1)Cc1ccccc1[O-]

STL046344
Synonyms: (E)- [4- (dimethylsulfamoyl)phenyl]{2- (5- methylfuran- 2- yl)- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: Cc1ccc(o1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)S(=O)(=O)N(C)C)/[O-]

STL046348
Synonyms: 2- [(4,5- dimethyl- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]- N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)acetamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSc1nc(C)c(c(=O)[nH]1)C

STL046358
Synonyms: 4- {(3E)- 2- (2- fluorophenyl)- 3- [hydroxy(phenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}benzenesulfonamide
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1F)c1ccc(cc1)S(=O)(=O)N)/c1ccccc1

STL046362
Synonyms: 3- (ethoxycarbonyl)- 1,2- dimethyl- 4- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 1H- indol- 5- olate
Smiles: CCOC(=O)c1c(C)n(c2c1c(C[NH+]1CCN(CC1)C)c([O-])cc2)C

STL046366
Synonyms: 4- (5- {(E)- [(4- hydroxy- 2- oxo- 1,2- dihydropyrimidin- 5- yl)imino]methyl}furan- 2- yl)benzoicacid
Smiles: Oc1nc(=O)[nH]cc1/N=C/c1ccc(o1)c1ccc(cc1)C(=O)O

STL046367
Synonyms: (E)- {1- (3- carboxypropyl)- 2- [4- (dimethylammonio)phenyl]- 4,5- dioxopyrrolidin- 3- ylidene}(phenyl)methanolate
Smiles: OC(=O)CCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/[O-])/C1c1ccc(cc1)[NH+](C)C

STL046377
Synonyms: 4- {[(2- fluorophenyl)carbonyl]oxy}- 1- methylpiperidinium
Smiles: C[NH+]1CCC(CC1)OC(=O)c1ccccc1F

STL046387
Synonyms: (5E)- 5- {[(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)amino]methylidene}- 1- (4- fluorophenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Fc1ccc(cc1)N1C(=NC(=O)/C(=C\Nc2c(=O)n(n(c2C)C)c2ccccc2)/C1=O)S

STL046391
Synonyms: (E)- (4- chlorophenyl){1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- phenylpyrrolidin- 3- ylidene}methanolate
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCCn1cc[nH+]c1)/[O-]

STL046397
Synonyms: (5Z)- 3- (4- chlorophenyl)- 6- hydroxy- 5- ({[2- (morpholin- 4- yl)ethyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C/NCCN2CCOCC2)/C1=O)O

STL046399
Synonyms: 1- {3- [4- (diethylamino)phenyl]- 11- (furan- 2- yl)- 1- hydroxy- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl}ethanone
Smiles: CCN(c1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N(C2c2ccco2)C(=O)C)C1)O)CC

STL046400
Synonyms: 4- [({[5- (4- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 2- ium- 3- yl]sulfanyl}acetyl)amino]benzoate
Smiles: O=C(Nc1ccc(cc1)C(=O)[O-])CSc1[nH+]nc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

STL046403
Synonyms: 8,8'- (ethane- 1,2- diyldisulfanediyl)bis{7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one}
Smiles: OC(Cn1c(SCCSc2nc3c(n2CC(COc2ccc(cc2)Cl)O)c(O)nc(=O)n3C)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)Cl

STL046413
Synonyms: (E)- 1- benzofuran- 2- yl{1- [3- (diethylammonio)propyl]- 2- (2- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: CC[NH+](CCCN1C(c2ccccc2F)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)CC

STL046421
Synonyms: N- [(2E)- 4,6- dimethylpyrimidin- 2(1H)- ylidene]- 4- (4- methoxyphenyl)piperazine- 1- carboximidamide
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=N)/N=c\1/nc(C)cc([nH]1)C

STL046445
Synonyms: (5E)- 1- [2- (4- fluorophenyl)ethyl]- 2- hydroxy- 5- [(5- methylthiophen- 2- yl)methylidene]pyrimidine- 4,6(1H,5H)- dione
Smiles: Fc1ccc(cc1)CCN1C(=NC(=O)/C(=C\c2ccc(s2)C)/C1=O)O

STL046448
Synonyms: 5- (phenoxymethyl)- 4- {[(E)- (3- phenoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1/N=C/c1cccc(c1)Oc1ccccc1)COc1ccccc1

STL046452
Synonyms: (6E)- N~2~- (4- methoxyphenyl)- 6- [(4- methoxyphenyl)imino]- N~4~- [2- (morpholin- 4- yl)ethyl]- 1,6- dihydro- 1,3,5- triazine- 2,4- diamine
Smiles: COc1ccc(cc1)Nc1nc(NCCN2CCOCC2)n/c(=N/c2ccc(cc2)OC)/[nH]1

STL046458
Synonyms: 1- {[(1- propyl- 1H- 3,1- benzimidazol- 3- ium- 2- yl)amino]methyl}naphthalen- 2- olate
Smiles: CCCn1c(NCc2c([O-])ccc3c2cccc3)[nH+]c2c1cccc2

STL046462
Synonyms: (5Z)- 5- ({[2- (diethylamino)ethyl]amino}methylidene)- 6- hydroxy- 3- (2,4,6- trimethylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CCN(CCN/C=C\1/C(=NC(=O)N(C1=O)c1c(C)cc(cc1C)C)O)CC

STL046489
Synonyms: (E)- {2- (3- chlorophenyl)- 1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}(2,8- dimethylimidazo[1,2- a]pyridin- 3- yl)methanolate
Smiles: Clc1cccc(c1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2C)/[O-]

STL046497
Synonyms: N- [1- (2,3- dimethoxybenzyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]furan- 2- carboxamide
Smiles: COc1c(cccc1OC)CN1C(=NC(C1=O)(NC(=O)c1ccco1)C(F)(F)F)O

STL046504
Synonyms: 8- [4- (2- hydroxyethyl)piperazin- 4- ium- 1- yl]- 7- [2- hydroxy- 3- (2,4,6- tribromophenoxy)propyl]- 3- methyl- 2- oxo- 3,7- dihydro- 2H- purin- 6- olate
Smiles: OCC[NH+]1CCN(CC1)c1nc2c(n1CC(COc1c(Br)cc(cc1Br)Br)O)c([O-])nc(=O)n2C

STL046516
Synonyms: (5E)- 1- (4- bromophenyl)- 5- (2,4- dihydroxybenzylidene)- 2- hydroxypyrimidine- 4,6(1H,5H)- dione
Smiles: Brc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(cc2O)O)/C1=O)O

STL046518
Synonyms: ethylN- ({5- [(4E)- 4- {[4- (2- amino- 2- oxoethoxy)phenyl]imino}- 3,4- dihydrophthalazin- 1- yl]- 2- methylphenyl}sulfonyl)glycinate
Smiles: CCOC(=O)CNS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N/c2ccc(cc2)OCC(=O)N)/c2c1cccc2

STL046521
Synonyms: 1- {3- [4- (diphenylmethyl)piperazin- 1- ium- 1- yl]propyl}- 1H- benzimidazol- 2- olate
Smiles: [O-]c1nc2c(n1CCC[NH+]1CCN(CC1)C(c1ccccc1)c1ccccc1)cccc2

STL046535
Synonyms: 2- (4- {[(1E)- 4- {3- [(2- hydroxyethyl)sulfamoyl]- 4- methylphenyl}phthalazin- 1(2H)- ylidene]amino}phenoxy)acetamide
Smiles: OCCNS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N/c2ccc(cc2)OCC(=O)N)/c2c1cccc2

STL046538
Synonyms: 4- [(E)- {2- [(1H- 3,1- benzimidazol- 3- ium- 2- ylsulfanyl)acetyl]hydrazinylidene}methyl]- 2- ethoxyphenolate
Smiles: CCOc1cc(/C=N/NC(=O)CSc2[nH]c3c([nH+]2)cccc3)ccc1[O-]

STL046543
Synonyms: 4- {[(E)- {1- [2- (3,4- dimethoxyphenyl)ethyl]- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene}methyl]amino}benzoicacid
Smiles: COc1ccc(cc1OC)CCN1C(=O)N=C(/C(=C\Nc2ccc(cc2)C(=O)O)/C1=O)O

STL046550
Synonyms: (E)- [4,5- dioxo- 2- phenyl- 1- (pyrimidin- 1- ium- 2- yl)pyrrolidin- 3- ylidene](phenyl)methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1ccccc1)c1nccc[nH+]1)/c1ccccc1

STL046551
Synonyms: 2- [(dimethylammonio)methyl]- 4- methyl- 6- oxo- 6H- benzo[c]chromen- 3- olate
Smiles: C[NH+](Cc1cc2c(c(c1[O-])C)oc(=O)c1c2cccc1)C

STL046558
Synonyms: (4E)- 4- [(2E)- (pyridin- 2- ylmethylidene)hydrazinylidene]- 3,4- dihydropyrimidin- 2(1H)- one
Smiles: O=c1[nH]cc/c(=N\N=C\c2ccccn2)/[nH]1

STL046561
Synonyms: N- (2,5- dimethylphenyl)- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]furan- 2- carboxamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccco1)Cc1cc2cc(C)ccc2[nH]c1=O)C

STL046562
Synonyms: 1- [(2E)- 4- methyl- 6- (trifluoromethyl)pyrimidin- 2(1H)- ylidene]- 3- (4- phenoxyphenyl)guanidine
Smiles: N=C(/N=c\1/nc(C)cc([nH]1)C(F)(F)F)Nc1ccc(cc1)Oc1ccccc1

STL046589
Synonyms: 4- methyl- 6- oxo- 2- (pyrrolidinium- 1- ylmethyl)- 6H- benzo[c]chromen- 3- olate
Smiles: [O-]c1c(C[NH+]2CCCC2)cc2c(c1C)oc(=O)c1c2cccc1

STL046602
Synonyms: 4- {[(E)- (6- hydroxy- 4- oxo- 2- sulfanylpyrimidin- 5(4H)- ylidene)methyl]amino}benzoicacid
Smiles: SC1=NC(=O)/C(=C/Nc2ccc(cc2)C(=O)O)/C(=N1)O

STL046608
Synonyms: (E)- {1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxo- 2- phenylpyrrolidin- 3- ylidene}(pyridin- 4- yl)methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccncc2)/[O-])/C(N1CCC[NH+]1CCOCC1)c1ccccc1

STL046626
Synonyms: (5Z)- 6- hydroxy- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)- 3- (2- phenylethyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/NCCCn2cncc2)/C(=O)N1CCc1ccccc1

STL046628
Synonyms: (5Z)- 3- (2- chlorophenyl)- 6- hydroxy- 5- ({[2- (morpholin- 4- yl)ethyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/NCCN2CCOCC2)/C(=O)N1c1ccccc1Cl

STL046629
Synonyms: 2- 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)ccc1[O-]

STL046631
Synonyms: N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 4- methylpyrimidin- 2- amine
Smiles: Cc1ccnc(n1)/N=c\1/sc2c([nH]1)cccc2

STL046651
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- (4- propoxyphenyl)pyrrolidin- 3- ylidene}(4- methoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OC)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL046652
Synonyms: (5Z)- 5- (1H- benzimidazol- 2- ylmethylidene)- 6- hydroxy- 3- (2- methoxyphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C/c2nc3c([nH]2)cccc3)/C1=O)O

STL046660
Synonyms: 3- [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (4- ethoxyphenyl)- 4,5- dioxopyrrolidin- 1- yl]propanoicacid
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCC(=O)O

STL046663
Synonyms: (E)- [4,5- dioxo- 2- phenyl- 1- (pyrimidin- 1- ium- 2- yl)pyrrolidin- 3- ylidene](4- methoxyphenyl)methanolate
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)c1nccc[nH+]1)/[O-]

STL046673
Synonyms: 6- methyl- 4- phenyl- 3- (piperidin- 1- yl)- 3,4- dihydroquinolin- 2- ol
Smiles: Cc1ccc2c(c1)C(c1ccccc1)C(C(=N2)O)N1CCCCC1

STL046685
Synonyms: 4- (methylsulfanyl)- 2- [(5Z)- 4- oxo- 5- (pyridinium- 4- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CSCCC(N1C(=S)S/C(=C\c2cc[nH+]cc2)/C1=O)C(=O)[O-]

STL046704
Synonyms: ethylN- {[5- (4- hydroxyphthalazin- 1- yl)- 2- methylphenyl]sulfonyl}glycinate
Smiles: CCOC(=O)CNS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)O

STL046709
Synonyms: 2- {[3- cyano- 6- hydroxy- 4- (2- methoxyphenyl)- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)N=C(CC1c1ccccc1OC)O

STL046713
Synonyms: (E)- {2- (4- chlorophenyl)- 1- [2- (dimethylammonio)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}(5- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methanolate
Smiles: C[NH+](CCN1C(c2ccc(cc2)Cl)/C(=C(/c2cnn(c2C)c2ccccc2)\[O-])/C(=O)C1=O)C

STL046718
Synonyms: 4- (benzo[cd]indolium- 2- ylamino)benzoate
Smiles: [O-]C(=O)c1ccc(cc1)NC1=[NH+]c2c3c1cccc3ccc2

STL046720
Synonyms: 5- (4- fluorophenyl)- 7- (furan- 2- yl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Fc1ccc(cc1)C1=CC(c2ccco2)n2c(=N1)[nH]cn2

STL046747
Synonyms: (E)- [2- (2,5- dimethoxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](4- fluorophenyl)methanolate
Smiles: COc1ccc(c(c1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1)OC

STL046752
Synonyms: (2E,5Z)- 2- [(4- hydroxyphenyl)imino]- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: C/C(=C\c1ccccc1)/C=C/1\S/C(=N/c2ccc(cc2)O)/N=C1O

STL046764
Synonyms: 6- methyl- 3- (morpholin- 4- ylmethyl)- 4- phenylquinolin- 2- ol
Smiles: Cc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)CN1CCOCC1

STL046766
Synonyms: 3- [(E)- 2- ethoxy- 2- hydroxyethenyl]- 2H- 1,4- benzoxazin- 2- one
Smiles: CCO/C(=C/c1nc2ccccc2oc1=O)/O

STL046771
Synonyms: 2- tert- butyl- 1,2,4- triazaspiro[4.5]dec- 3- ene- 3- thiol
Smiles: CC(N1NC2(N=C1S)CCCCC2)(C)C

STL046778
Synonyms: 1- heptyl- 2- hydroxy- 4- oxo- N'- [(E)- pyridin- 4- ylmethylidene]- 1,4- dihydroquinoline- 3- carbohydrazide
Smiles: CCCCCCCn1c(O)c(C(=O)N/N=C/c2ccncc2)c(=O)c2c1cccc2

STL046780
Synonyms: 2- fluoro- N- [3- (4- methyl- 5- sulfanyl- 4H- 1,2,4- triazol- 3- yl)phenyl]benzamide
Smiles: O=C(c1ccccc1F)Nc1cccc(c1)c1nnc(n1C)S

STL046782
Synonyms: (5E)- 3- benzyl- 5- ({[4- (diethylamino)phenyl]amino}methylidene)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCN(c1ccc(cc1)N/C=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)CC

STL046788
Synonyms: 3- [(Z)- 2- (2,4- dimethyl- 1,3- oxazol- 5- yl)- 2- hydroxyethenyl]- 7- nitro- 2H- 1,4- benzoxazin- 2- one
Smiles: Cc1nc(c(o1)/C(=C/c1nc2ccc(cc2oc1=O)[N+](=O)[O-])/O)C

STL046790
Synonyms: 2,4- dihydroxy- N- (2- methoxyphenyl)- 5,6,7,8- tetrahydroquinoline- 3- carboxamide
Smiles: COc1ccccc1NC(=O)c1c(O)nc2c(c1O)CCCC2

STL046798
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (pyridin- 3- yl)pyrrolidin- 3- ylidene][2- methyl- 4- (propan- 2- yloxy)phenyl]methanolate
Smiles: CC(Oc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)Cc1ccc[nH+]c1)/[O-])C

STL046804
Synonyms: 6- hydroxy- 3- methyl- 8- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 7- (3- phenylpropyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(=C)CSc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

STL046818
Synonyms: N- {2- oxo- 1- (4- oxo- 3,4- dihydrophthalazin- 1- yl)- 2- [(2E)- 2- (pyridin- 3- ylmethylidene)hydrazinyl]ethyl}benzamide
Smiles: O=C(c1ccccc1)NC(c1n[nH]c(=O)c2c1cccc2)C(=O)N/N=C/c1cccnc1

STL046823
Synonyms: N'- (4,6- dihydroxy- 5- nitropyrimidin- 2- yl)pyridine- 2- carbohydrazide
Smiles: O=C(c1ccccn1)NNc1nc(O)c(c(n1)O)[N+](=O)[O-]

STL046833
Synonyms: 5- benzyl- 6- hydroxy- 2- [(2- oxo- 2- phenylethyl)sulfanyl]- 1- phenylpyrimidin- 4(1H)- one
Smiles: O=C(c1ccccc1)CSc1nc(=O)c(c(n1c1ccccc1)O)Cc1ccccc1

STL046840
Synonyms: (E)- {2- (4- chlorophenyl)- 1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}(2,4- dimethyl- 1,3- thiazol- 5- yl)methanolate
Smiles: Clc1ccc(cc1)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[O-]

STL046847
Synonyms: 7- methyl- 3- {[(3- methylphenyl)amino]methyl}quinolin- 2(1H)- one
Smiles: Cc1cccc(c1)NCc1cc2ccc(cc2[nH]c1=O)C

STL046848
Synonyms: 6- methyl- 2- sulfanylthieno[2,3- d]pyrimidin- 4- ol
Smiles: Sc1nc(O)c2c(n1)sc(c2)C

STL046854
Synonyms: 7- hydroxy- 4- (4- methoxyphenyl)- 1- (pentan- 2- yl)- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: CCCC(n1[nH]c(=O)c2c1N=C(O)CSC2c1ccc(cc1)OC)C

STL046865
Synonyms: (E)- furan- 2- yl{1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- (4- propoxyphenyl)pyrrolidin- 3- ylidene}methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccco2)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL046866
Synonyms: ethyl4- ({(1E)- 1- [1- (1,3- benzothiazol- 2- yl)- 5- oxo- 3- propyl- 4,5- dihydro- 1H- pyrazol- 4- yl]ethylidene}amino)benzoate
Smiles: CCCC1=NN(C(=O)C1/C(=N/c1ccc(cc1)C(=O)OCC)/C)c1nc2c(s1)cccc2

STL046869
Synonyms: (4E)- 3- nitro- 4- (phenylimino)- 4H- chromen- 2- ol
Smiles: [O-][N+](=O)c1c(O)oc2c(/c/1=N\c1ccccc1)cccc2

STL046884
Synonyms: methyl(2Z)- [(2Z)- 2- [(2E)- benzylidenehydrazinylidene]- 4- hydroxy- 1,3- thiazol- 5(2H)- ylidene]ethanoate
Smiles: COC(=O)/C=C/1\S/C(=N\N=C\c2ccccc2)/N=C1O

STL046885
Synonyms: 7- bromo- 5- (2- chlorophenyl)- 2- hydroxy- 3H- 1,4- benzodiazepin- 3- ylpropanoate
Smiles: CCC(=O)OC1N=C(c2c(N=C1O)ccc(c2)Br)c1ccccc1Cl

STL046891
Synonyms: ethyl(2Z)- 2- [(3- chlorophenyl)imino]- 4- hydroxy- 2,5- dihydrofuran- 3- carboxylate
Smiles: CCOC(=O)C1=C(O)CO/C/1=N\c1cccc(c1)Cl

STL046894
Synonyms: 3- (1- methyl- 1H- benzimidazol- 2- yl)- 8- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 2- oxo- 2H- chromen- 7- olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(=O)c(c2)c1nc2c(n1C)cccc2

STL046899
Synonyms: 5- bromo- 2- hydroxy- 6'- methyl- 2'- phenyl- 4H- 1,4'- bipyrimidin- 4- one
Smiles: Cc1nc(nc(c1)n1cc(Br)c(=O)nc1O)c1ccccc1

STL046902
Synonyms: 5- butyl- 2- (4- chlorophenyl)- 5- methyl- 2,5- dihydro- 1H- 1,2,4- triazole- 3- thiol
Smiles: CCCCC1(C)NN(C(=N1)S)c1ccc(cc1)Cl

STL046907
Synonyms: N- [(2E)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 6- hydroxy- 4- oxo- 1,2- dihydro- 4H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: CCc1n[nH]/c(=N\C(=O)c2c(O)c3cccc4c3n(c2=O)CC4)/s1

STL046924
Synonyms: 6- hydroxy- 3- methyl- 8- (2- methylpiperidin- 1- yl)- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(=C)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCCCC1C

STL046933
Synonyms: 2- (3- hydroxy- 5- methyl- 1H- pyrazol- 4- yl)- N'- [(E)- (2,4,5- trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)Cc1c(C)[nH]nc1O)OC

STL046942
Synonyms: 4- hydroxy- N- (2- methyl- 4- oxoquinazolin- 3(4H)- yl)- 6- oxo- 1,2- dihydro- 6H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: Cc1nc2ccccc2c(=O)n1NC(=O)c1c(O)n2CCc3c2c(c1=O)ccc3

STL046944
Synonyms: 1- hexyl- 2- hydroxy- 4- oxo- N- (pyrazin- 2- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCn1c(O)c(C(=O)Nc2cnccn2)c(=O)c2c1cccc2

STL046946
Synonyms: N'- {(E)- [4,6- dioxo- 1- (prop- 2- en- 1- yl)- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}pyridine- 4- carbohydrazide
Smiles: C=CCN1C(=NC(=O)/C(=C\NNC(=O)c2ccncc2)/C1=O)S

STL046951
Synonyms: N- {2- oxo- 1- (4- oxo- 3,4- dihydrophthalazin- 1- yl)- 2- [(2E)- 2- (pyridin- 4- ylmethylidene)hydrazinyl]ethyl}benzamide
Smiles: O=C(c1ccccc1)NC(c1n[nH]c(=O)c2c1cccc2)C(=O)N/N=C/c1ccncc1

STL046958
Synonyms: 7- benzyl- 2- (dimethylamino)- 7H- purin- 6- ol
Smiles: CN(c1nc(O)c2c(n1)ncn2Cc1ccccc1)C

STL046977
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 2- (ethoxycarbonyl)- 6- ethyl- 8- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 4- oxo- 4H- chromen- 7- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])c(CC)cc2c1oc(C(=O)OCC)c(c2=O)c1nc2c(s1)cccc2

STL046988
Synonyms: 6- chloro- 3- [4- (3- methoxyphenyl)piperazin- 1- yl]- 4- phenylquinolin- 2- ol
Smiles: COc1cccc(c1)N1CCN(CC1)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STL047009
Synonyms: (E)- {2- (4- methylphenyl)- 1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}(5- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methanolate
Smiles: Cc1ccc(cc1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cnn(c1C)c1ccccc1)/[O-]

STL047012
Synonyms: 2- hydroxy- 4- oxo- 1- (prop- 2- en- 1- yl)- N'- [(E)- pyridin- 2- ylmethylidene]- 1,4- dihydroquinoline- 3- carbohydrazide
Smiles: C=CCn1c(O)c(C(=O)N/N=C/c2ccccn2)c(=O)c2c1cccc2

STL047018
Synonyms: methyl{[3- cyano- 4- (2,3- dichlorophenyl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetate
Smiles: COC(=O)CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1cccc(c1Cl)Cl

STL047025
Synonyms: ethyl[(5- {[(4- hydroxy- 5,6- dimethylthieno[2,3- d]pyrimidin- 2- yl)sulfanyl]methyl}- 4- methyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nnc(n1C)CSc1nc(O)c2c(n1)sc(c2C)C

STL047028
Synonyms: 1- (2- fluorophenyl)- 3- [(2Z)- 5- propyl- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: CCCc1n[nH]/c(=N/C(=O)Nc2ccccc2F)/s1

STL047033
Synonyms: (3Z)- 1- benzyl- 3- [(4- hydroxyquinazolin- 2- yl)methylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1/C(=C\c2nc(O)c3c(n2)cccc3)/c2c(N1Cc1ccccc1)cccc2

STL047054
Synonyms: 1- (3,4- dimethylphenyl)- 3- [(2Z)- 5- (3- methoxyphenyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: COc1cccc(c1)c1n[nH]/c(=N/C(=O)Nc2ccc(c(c2)C)C)/s1

STL047067
Synonyms: N- [N- (4,6- dimethylpyrimidin- 2- yl)- N'- (2- methoxyphenyl)carbamimidoyl]- 1- phenylmethanesulfonamide
Smiles: COc1ccccc1/N=C(/NS(=O)(=O)Cc1ccccc1)\Nc1nc(C)cc(n1)C

STL047073
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxo- 2- phenylpyrrolidin- 3- ylidene}(4- propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCCn1c[nH+]cc1)/[O-]

STL047085
Synonyms: (E)- [2- (4- ethoxy- 3- methoxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](phenyl)methanolate
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL047087
Synonyms: N- [(Z)- [(2Z)- 1,3- benzothiazol- 2(3H)- ylideneamino]{[(4- fluorophenyl)carbonyl]amino}methylidene]- 3- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)N/C(=N/C(=O)c1cccc(c1)F)/N=c/1\sc2c([nH]1)cccc2

STL047095
Synonyms: N- (1,3- dihydro- 2H- benzimidazol- 2- ylidene)- 4- hydroxy- 1- octyl- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCCn1c(=O)c(C(=O)/N=c/2\[nH]c3c([nH]2)cccc3)c(c2c1cccc2)O

STL047099
Synonyms: methyl3- (4- hydroxy- 6- methyl- 2- sulfanylpyrimidin- 5- yl)propanoate
Smiles: COC(=O)CCc1c(C)nc(nc1O)S

STL047106
Synonyms: N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- phenylpyridine- 4- carboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)c1ccncc1)c1ccccc1

STL047112
Synonyms: 5- {(4E)- 4- [(4- hydroxyphenyl)imino]- 3,4- dihydrophthalazin- 1- yl}- 2- methyl- N- (tetrahydrofuran- 2- ylmethyl)benzenesulfonamide
Smiles: Oc1ccc(cc1)/N=c\1/[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NCC1CCCO1)C

STL047122
Synonyms: ethyl(2Z)- 4- (phenylamino)- 2- (phenylimino)- 1,2- dihydroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1/c(=N/c2ccccc2)/[nH]c2c(c1Nc1ccccc1)cccc2

STL047126
Synonyms: (2Z)- 2- {[(4- fluorophenyl)carbonyl]imino}- 5- methyl- 2,3- dihydro- 1,3- thiazol- 4- yl4- fluorobenzoate
Smiles: Fc1ccc(cc1)C(=O)Oc1[nH]/c(=N/C(=O)c2ccc(cc2)F)/sc1C

STL047131
Synonyms: 5- phenyl- 4,6,7,8- tetrahydrocyclopenta[d]pyrazolo[3,4- b]pyridin- 1- amine
Smiles: Nc1nnc2c1c1CCCc1c([nH]2)c1ccccc1

STL047139
Synonyms: (E)- (3- methoxyphenyl)[2- (4- nitrophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1ccc[nH+]c1)/[O-]

STL047140
Synonyms: (5Z)- 5- (2,3- dimethoxybenzylidene)- 1- (2- fluorophenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: COc1cccc(c1OC)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1F)S

STL047141
Synonyms: 2- {4- methyl- 5- [(E)- 2- phenylethenyl]- 4H- 1,2,4- triazol- 2- ium- 3- yl}phenolate
Smiles: Cn1c(/C=C/c2ccccc2)n[nH+]c1c1ccccc1[O-]

STL047153
Synonyms: N- (4- methoxyphenyl)- 3- nitro- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: COc1ccc(cc1)N(C(=O)c1cccc(c1)[N+](=O)[O-])Cc1cc2ccccc2[nH]c1=O

STL047173
Synonyms: 2- (2,4- dimethylphenyl)- 1- [(2E)- 6- (methoxymethyl)- 4- oxo- 3,4- dihydropyrimidin- 2(1H)- ylidene]guanidine
Smiles: COCc1cc(=O)[nH]/c(=N/C(=N/c2ccc(cc2C)C)/N)/[nH]1

STL047175
Synonyms: N- [(2E)- 5- [(2,4- dimethylphenoxy)methyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]furan- 2- carboxamide
Smiles: Cc1ccc(c(c1)C)OCc1n[nH]/c(=N\C(=O)c2ccco2)/s1

STL047176
Synonyms: (E)- (2,4- dimethyl- 1,3- thiazol- 5- yl){1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxo- 2- (pyridin- 3- yl)pyrrolidin- 3- ylidene}methanolate
Smiles: Cc1nc(c(s1)/C(=C\1/C(c2cccnc2)N(C(=O)C1=O)CC[NH+]1CCOCC1)/[O-])C

STL047181
Synonyms: phthalazine- 1,4- diol
Smiles: Oc1nnc(c2c1cccc2)O

STL047193
Synonyms: 5- amino- 7- (4- chlorophenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)N=c2n(C1c1ccc(cc1)Cl)nc[nH]2

STL047199
Synonyms: (E)- [2- (4- chlorophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene](thiophen- 2- yl)methanolate
Smiles: Clc1ccc(cc1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL047200
Synonyms: 5- (1,3- benzodioxol- 5- ylmethyl)- 6- hydroxy- 2- oxo- 2,3- dihydropyrimidin- 4- olate
Smiles: Oc1nc(=O)[nH]c(c1Cc1ccc2c(c1)OCO2)[O-]

STL047204
Synonyms: 6- chloro- 3- [(Z)- 2- (4- chlorophenyl)- 2- hydroxyethenyl]- 2H- 1,4- benzoxazin- 2- one
Smiles: Clc1ccc(cc1)/C(=C/c1nc2cc(Cl)ccc2oc1=O)/O

STL047210
Synonyms: (5Z)- 1- phenyl- 2- sulfanyl- 5- (2,3,4- trimethoxybenzylidene)pyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccc(c(c1OC)OC)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1)S

STL047213
Synonyms: 3- {[6- hydroxy- 3- methyl- 2- oxo- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 2H- purin- 8- yl]sulfanyl}propanoicacid
Smiles: C=CCn1c(SCCC(=O)O)nc2c1c(O)nc(=O)n2C

STL047217
Synonyms: 5,5'- bis(4- chlorophenyl)- 2,2'- diphenyltetrahydro- 2H,2'H- 3,3'- bipyrrolo[3,4- d][1,2]oxazole- 4,4',6,6'(3H,3'H,5H,5'H)- tetrone
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)Cl)c1ccccc1)c1ccccc1

STL047229
Synonyms: ethyl6- chloro- 1- ethyl- 2- hydroxy- 4- oxo- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CCn1c(O)c(C(=O)OCC)c(=O)c2c1ccc(c2)Cl

STL047250
Synonyms: 5- cyclohexyl- 4- {[(E)- (3- ethoxy- 4- hydroxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1C1CCCCC1

STL047259
Synonyms: 7- (4- fluorophenyl)- 5- (4- methylphenyl)- 3,7- dihydrotetrazolo[1,5- a]pyrimidine
Smiles: Cc1ccc(cc1)C1=CC(n2c(=N1)[nH]nn2)c1ccc(cc1)F

STL047261
Synonyms: 3,4,5- trimethoxy- 2- [({[(1- methyl- 1H- tetrazol- 4- ium- 5- yl)sulfanyl]acetyl}amino)methyl]benzoate
Smiles: COc1c(CNC(=O)CSc2[nH+]nnn2C)c(cc(c1OC)OC)C(=O)[O-]

STL047267
Synonyms: 4- (2- bromophenyl)- 1- chloro- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinolinium- 6- carboxylate
Smiles: ClC1C(Sc2ccccc2[N+](=O)[O-])CC2C1c1cccc(c1[NH2+]C2c1ccccc1Br)C(=O)[O-]

STL047284
Synonyms: 2- hydroxy- 1- methyl- 4- oxo- N'- [(E)- pyridin- 3- ylmethylidene]- 1,4- dihydroquinoline- 3- carbohydrazide
Smiles: O=C(c1c(=O)c2ccccc2n(c1O)C)N/N=C/c1cccnc1

STL047305
Synonyms: (E)- {2- (3- chlorophenyl)- 1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}(5- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methanolate
Smiles: Clc1cccc(c1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cnn(c1C)c1ccccc1)/[O-]

STL047308
Synonyms: N- [2- (2- {(Z)- [1- (4- methylphenyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 1H- indol- 3- yl)ethyl]acetamide
Smiles: CC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)c2ccc(cc2)C)S)[nH]c2c1cccc2

STL047310
Synonyms: 5- cyclohexyl- 4- {[(E)- (4- hydroxy- 3,5- dimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2C2CCCCC2)cc(c1O)OC

STL047311
Synonyms: 5- [(4Z)- 4- (1,3- benzodioxol- 5- ylimino)- 3,4- dihydrophthalazin- 1- yl]- N,2- dimethylbenzenesulfonamide
Smiles: CNS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N\c2ccc3c(c2)OCO3)/c2c1cccc2

STL047314
Synonyms: (2Z)- 2- (1H- benzimidazol- 2- yl)- 3- hydroxy- 4- (4- methoxyphenoxy)but- 2- enenitrile
Smiles: COc1ccc(cc1)OC/C(=C(/c1nc2c([nH]1)cccc2)\C#N)/O

STL047315
Synonyms: 1- (4- ethoxyphenyl)- 3- [(5- ethyl- 4- hydroxy- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]pyrrolidine- 2,5- dione
Smiles: CCOc1ccc(cc1)N1C(=O)CC(C1=O)Sc1nc(O)c(c(=O)[nH]1)CC

STL047319
Synonyms: [(2Z)- 2- {(2E)- [4- (dimethylammonio)benzylidene]hydrazinylidene}- 4- hydroxy- 2,5- dihydro- 1,3- thiazol- 5- yl]acetate
Smiles: [O-]C(=O)CC1S/C(=N\N=C\c2ccc(cc2)[NH+](C)C)/N=C1O

STL047335
Synonyms: 2- methoxy- 6- {(E)- [(2Z)- [1,2,4]triazolo[3,4- a]phthalazin- 6(5H)- ylidenehydrazinylidene]methyl}phenol
Smiles: COc1cccc(c1O)/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2

STL047344
Synonyms: (5Z)- 3- hexyl- 6- hydroxy- 5- {[(4- methylpiperazin- 1- yl)amino]methylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: CCCCCCN1C(=O)N=C(/C(=C/NN2CCN(CC2)C)/C1=O)O

STL047349
Synonyms: 1- [11- (2,4- dimethoxyphenyl)- 1- hydroxy- 3,3- dimethyl- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl]- 2- methylpropan- 1- one
Smiles: COc1ccc(c(c1)OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(C)C)cccc2)(C)C

STL047368
Synonyms: (5E)- 4- hydroxy- 5- [2- (morpholin- 4- yl)- 2- oxoethylidene]- 1,3- thiazol- 2(5H)- one
Smiles: O=C(N1CCOCC1)/C=C\1/SC(=O)N=C1O

STL047370
Synonyms: (2Z)- 4- (4- chlorophenyl)- 2- [(2Z)- (2,4- dimethoxybenzylidene)hydrazinylidene]- 6- (trifluoromethyl)- 1,2- dihydropyrimidine
Smiles: COc1cc(OC)ccc1/C=N\N=c\1/nc(cc([nH]1)C(F)(F)F)c1ccc(cc1)Cl

STL047378
Synonyms: 2,4- dihydroxy- 5,6,7,8- tetrahydroquinoline- 3- carbohydrazide
Smiles: NNC(=O)c1c(O)nc2c(c1O)CCCC2

STL047391
Synonyms: 6- hydroxy- 7- (2- methoxyethyl)- 3- methyl- 8- (4- methylpiperidin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: COCCn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)C

STL047392
Synonyms: 2- {[(4- hydroxy- 6- propylpyrimidin- 2- yl)sulfanyl]methyl}quinazolin- 4- ol
Smiles: CCCc1nc(SCc2nc(O)c3c(n2)cccc3)nc(c1)O

STL047395
Synonyms: 2- methoxy- 5- [(E)- {2- [(1- methyl- 1H- indolium- 3- yl)carbonyl]hydrazinylidene}methyl]phenolate
Smiles: COc1ccc(cc1[O-])/C=N/NC(=O)C1=C[NH+](c2c1cccc2)C

STL047396
Synonyms: (5E)- 6- hydroxy- 3- (2- methoxyphenyl)- 5- [(piperidin- 1- ylamino)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C\NN2CCCCC2)/C1=O)O

STL047413
Synonyms: 7- butyl- 6- hydroxy- 3- methyl- 8- [(2- oxopropyl)sulfanyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCn1c(SCC(=O)C)nc2c1c(O)nc(=O)n2C

STL047419
Synonyms: (5E)- 1- (4- methylphenyl)- 5- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Cc1ccc(cc1)N1C(=NC(=O)/C(=C\NCCCN2CCOCC2)/C1=O)S

STL047436
Synonyms: 2,3- dimethoxy- 6- {(E)- [2- ({[4- phenyl- 5- (3,4,5- trimethoxyphenyl)- 4H- 1,2,4- triazol- 2- ium- 3- yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: COc1c(OC)ccc(c1C(=O)[O-])/C=N/NC(=O)CSc1[nH+]nc(n1c1ccccc1)c1cc(OC)c(c(c1)OC)OC

STL047441
Synonyms: (3- {(E)- [2- (1,3- benzothiazol- 3- ium- 2- yl)hydrazinylidene]methyl}phenoxy)acetate
Smiles: [O-]C(=O)COc1cccc(c1)/C=N/Nc1sc2c([nH+]1)cccc2

STL047442
Synonyms: dimethyl5- [({(2E)- 4- hydroxy- 2- [(4- methylphenyl)imino]- 5,6- dihydro- 2H- 1,3- thiazin- 6- yl}carbonyl)amino]benzene- 1,3- dicarboxylate
Smiles: COC(=O)c1cc(NC(=O)C2CC(=N/C(=N\c3ccc(cc3)C)/S2)O)cc(c1)C(=O)OC

STL047445
Synonyms: (E)- {2- (3- chlorophenyl)- 1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 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(C1c1cccc(c1)Cl)CCCn1c[nH+]cc1)/[O-]

STL047451
Synonyms: 2- [(1H- 3,1- benzimidazol- 3- ium- 2- ylamino)methyl]- 4- chlorophenolate
Smiles: Clc1ccc(c(c1)CNc1[nH]c2c([nH+]1)cccc2)[O-]

STL047452
Synonyms: 2- hydroxy- 4- oxo- 1- propyl- N- (pyrazin- 2- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCn1c(O)c(C(=O)Nc2cnccn2)c(=O)c2c1cccc2

STL047458
Synonyms: N- [(4E)- 1,7- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- ylidene]- 2,4- dimethylaniline
Smiles: Cc1ccc(c(c1)C)/N=c\1/nc[nH]c2c1cn[nH]2

STL047464
Synonyms: (5E)- 5- [(3- methylphenyl)imino]- 5H- anthra[1,9- cd][1,2]oxazol- 6- ol
Smiles: Cc1cccc(c1)/N=C/1\C=Cc2c3c1c(O)c1ccccc1c3on2

STL047465
Synonyms: N- [1- benzyl- 4- hydroxy- 2,6- dioxo- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]furan- 2- carboxamide
Smiles: O=C1Nc2c(C1(NC(=O)c1ccco1)C(F)(F)F)c(O)nc(=O)n2Cc1ccccc1

STL047480
Synonyms: (6- bromo- 2- methyl- 4- phenylquinazolin- 3- ium- 3(4H)- yl)acetate
Smiles: [O-]C(=O)C[NH+]1C(=Nc2c(C1c1ccccc1)cc(cc2)Br)C

STL047484
Synonyms: (E)- 1- benzofuran- 2- yl{2- (4- chlorophenyl)- 1- [2- (dimethylammonio)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: C[NH+](CCN1C(c2ccc(cc2)Cl)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)C

STL047486
Synonyms: (E)- {1- [2- (diethylammonio)ethyl]- 2- (4- methoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(thiophen- 2- yl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2cccs2)/[O-])/C1c1ccc(cc1)OC)CC

STL047494
Synonyms: N- [2- hydroxy- 5- oxo- 1- (3- phenylpropyl)- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]- 2,3,4- trimethoxybenzamide
Smiles: COc1c(ccc(c1OC)OC)C(=O)NC1(N=C(N(C1=O)CCCc1ccccc1)O)C(F)(F)F

STL047511
Synonyms: N- [5- (4- chlorophenyl)- 7- (2- methoxyphenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]methanesulfonamide
Smiles: COc1ccccc1C1C=C(N=c2n1nc([nH]2)NS(=O)(=O)C)c1ccc(cc1)Cl

STL047523
Synonyms:
Smiles: CCOC(=O)c1c[nH]c2c(c1=O)ccc1c2nsn1

STL047545
Synonyms: N- (2,4- dimethylphenyl)- 2,4- dihydroxy- 5,6,7,8- tetrahydroquinoline- 3- carboxamide
Smiles: Cc1ccc(c(c1)C)NC(=O)c1c(O)nc2c(c1O)CCCC2

STL047547
Synonyms: (2Z)- 2- [(2E)- (2,5- dimethoxybenzylidene)hydrazinylidene]- 4- methyl- 1,2- dihydroquinoline
Smiles: COc1ccc(cc1/C=N/N=c\1/cc(C)c2c([nH]1)cccc2)OC

STL047549
Synonyms: 2,6- dichloro- 4- [(Z)- (3- oxo[1,3]thiazolo[3,2- a]benzimidazol- 9- ium- 2(3H)- ylidene)methyl]phenolate
Smiles: [O-]c1c(Cl)cc(cc1Cl)/C=c/1\sc2n(c1=O)c1c([nH+]2)cccc1

STL047551
Synonyms: 6- hydroxy- 3- methyl- 8- (4- phenylpiperazin- 1- yl)- 7- {2- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]ethyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: O=c1nc(O)c2c(n1C)nc(n2CCSc1nnnn1c1ccccc1)N1CCN(CC1)c1ccccc1

STL047552
Synonyms: 7- methyl- 5- phenyl- 3H- 1,4- benzodiazepine- 2,3- diol
Smiles: Cc1ccc2c(c1)C(=NC(C(=N2)O)O)c1ccccc1

STL047553
Synonyms: N- [(2E)- 3- (thiophen- 2- yl)prop- 2- enoyl]morpholine- 4- carbimidothioicacid
Smiles: O=C(/N=C(/N1CCOCC1)\S)/C=C/c1cccs1

STL047556
Synonyms: 4- [(2E)- pyrrolidin- 2- ylideneammonio]butanoate
Smiles: [O-]C(=O)CCC/[NH+]=C/1\CCCN1

STL047559
Synonyms: (5Z)- 6- hydroxy- 3- methyl- 5- (3- phenoxybenzylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/c2cccc(c2)Oc2ccccc2)/C(=O)N1C

STL047595
Synonyms: N- [(2Z)- 7,7- dimethyl- 5- oxo- 5,6,7,8- tetrahydroquinazolin- 2(1H)- ylidene]pentanamide
Smiles: CCCCC(=O)/N=c/1\ncc2c([nH]1)CC(CC2=O)(C)C

STL047602
Synonyms: 7- hydroxy- 5- oxo- N- [(2E)- 4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2(3H)- ylidene]- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: O=C(c1c(O)c2cccc3c2n(c1=O)CCC3)/N=c\1/scc([nH]1)C12CC3CC(C2)CC(C1)C3

STL047609
Synonyms: 5- ethyl- 2- phenyl- 5- (propan- 2- yl)- 2,5- dihydro- 1H- 1,2,4- triazole- 3- thiol
Smiles: CCC1(N=C(N(N1)c1ccccc1)S)C(C)C

STL047610
Synonyms: (3- bromophenyl)[5- (5- chloro- 2- hydroxyphenyl)- 1H- pyrazol- 4- yl]methanone
Smiles: Clc1ccc(c(c1)c1[nH]ncc1C(=O)c1cccc(c1)Br)O

STL047619
Synonyms: 3- (2- methylpropyl)- 2- sulfanyl- 3,5,6,7- tetrahydro- 4H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(Cn1c(S)nc2c(c1=O)c1CCCc1s2)C

STL047626
Synonyms: 3- [2- (3,4- dimethoxyphenyl)ethyl]- 2,6- dihydroxy- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)pyrimidin- 4(3H)- one
Smiles: COc1cc(ccc1OC)CCn1c(O)nc(c(c1=O)C1NCCc2c1cccc2)O

STL047636
Synonyms: (2- {(E)- [1- (4- fluorobenzyl)- 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)Cc1ccc(cc1)F)O

STL047637
Synonyms: N- ethyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]cyclohexanecarboxamide
Smiles: CCN(C(=O)C1CCCCC1)Cc1cc2ccc(cc2[nH]c1=O)C

STL047643
Synonyms: N- [(2E)- 6- methoxy- 4- methylquinazolin- 2(1H)- ylidene]- 4- methyl- 6- (trifluoromethyl)pyrimidin- 2- amine
Smiles: COc1ccc2c(c1)c(C)n/c(=N/c1nc(C)cc(n1)C(F)(F)F)/[nH]2

STL047646
Synonyms: N- [(4- hydroxy- 2- thioxopyrimidin- 1(2H)- yl)methyl]benzamide
Smiles: Oc1ccn(c(=S)n1)CNC(=O)c1ccccc1

STL047648
Synonyms: (5Z)- 1- ethyl- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCN1C(=NC(=O)/C(=C/c2cccn2C)/C1=O)S

STL047673
Synonyms: (5E)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CN(CCCN/C=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)C

STL047680
Synonyms: N- ethyl- 3- methoxy- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: CCN(C(=O)c1cccc(c1)OC)Cc1cc2cccc(c2[nH]c1=O)C

STL047681
Synonyms: (2Z)- 2- [(4- bromophenyl)imino]- 4- hydroxy- 3- (morpholin- 4- yl)naphthalen- 1(2H)- one
Smiles: Brc1ccc(cc1)/N=C\1/C(=C(O)c2c(C1=O)cccc2)N1CCOCC1

STL047686
Synonyms: 1- (3- methoxyphenyl)- 3- [(2E)- 5- (propan- 2- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]urea
Smiles: COc1cccc(c1)NC(=O)/N=c/1\[nH]nc(s1)C(C)C

STL047687
Synonyms: 3,3- dimethyl- N- [(2Z)- 4- phenyl- 1,3- thiazol- 2(3H)- ylidene]- 3,4- dihydroisoquinolin- 1- amine
Smiles: CC1(C)Cc2ccccc2C(=N1)/N=c/1\scc([nH]1)c1ccccc1

STL047698
Synonyms: 4- {(E)- [(2E)- phthalazin- 1(2H)- ylidenehydrazinylidene]methyl}- N,N- dipropylaniline
Smiles: CCCN(c1ccc(cc1)/C=N/N=c\1/[nH]ncc2c1cccc2)CCC

STL047705
Synonyms: 1- (butan- 2- yl)- 4- (4- ethoxyphenyl)- 7- hydroxy- 1,2,4,6- tetrahydro- 3H- pyrazolo[3,4- e][1,4]thiazepin- 3- one
Smiles: CCOc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C(CC)C)O

STL047706
Synonyms: 5- {(4E)- 4- [(2,4- dimethylphenyl)imino]- 3,4- dihydrophthalazin- 1- yl}- N- (2- hydroxyethyl)- 2- methylbenzenesulfonamide
Smiles: OCCNS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N/c2ccc(cc2C)C)/c2c1cccc2

STL047724
Synonyms: 5- (2- acetyl- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 3- butyl- 6- hydroxy- 2- sulfanylpyrimidin- 4(3H)- one
Smiles: CCCCn1c(S)nc(c(c1=O)C1N(CCc2c1cc(OC)c(c2)OC)C(=O)C)O

STL047726
Synonyms: N- (3,4- dimethylphenyl)- 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)c1ccc(c(c1)C)C

STL047727
Synonyms: (E)- (3,4- dimethoxyphenyl)[2- (4- fluorophenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: COc1ccc(cc1OC)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)Cc1ccc[nH+]c1)/[O-]

STL047730
Synonyms: (5Z)- 6- hydroxy- 3- (2- methoxyphenyl)- 5- [(3- methylthiophen- 2- yl)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C/c2sccc2C)/C1=O)O

STL047740
Synonyms: 4- {[(E)- (5- bromo- 2- hydroxyphenyl)methylidene]amino}- 5- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1cccnc1)O

STL047749
Synonyms: (4E)- 5- (4- fluorophenyl)- 1- (2- hydroxyethyl)- 4- [(2E)- 1- hydroxy- 3- phenylprop- 2- en- 1- ylidene]pyrrolidine- 2,3- dione
Smiles: OCCN1C(c2ccc(cc2)F)/C(=C(/C=C/c2ccccc2)\O)/C(=O)C1=O

STL047750
Synonyms: N- (1H- benzimidazol- 2- ylmethyl)- 2- methyl- 5- [(4E)- 4- (phenylimino)- 3,4- dihydrophthalazin- 1- yl]benzenesulfonamide
Smiles: Cc1ccc(cc1S(=O)(=O)NCc1nc2c([nH]1)cccc2)c1n[nH]/c(=N/c2ccccc2)/c2c1cccc2

STL047758
Synonyms: 8- (2- {(Z)- [1- (4- fluorobenzyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}hydrazinyl)- 1,3,7- trimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)CN1C(=NC(=O)/C(=C/NNc2nc3c(n2C)c(=O)n(c(=O)n3C)C)/C1=O)S

STL047761
Synonyms: (E)- [1- (1,3- benzothiazol- 3- ium- 2- yl)- 2- (4- methylphenyl)- 4,5- dioxopyrrolidin- 3- ylidene](4- methylphenyl)methanolate
Smiles: Cc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1c1sc2c([nH+]1)cccc2

STL047765
Synonyms: 4- (4- methylphenyl)- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1c1ccc(cc1)C

STL047769
Synonyms: 1- benzyl- 2- methyl- N- [(1Z)- 4- methylphthalazin- 1(2H)- ylidene]- 1H- benzimidazol- 5- amine
Smiles: Cc1nc2c(n1Cc1ccccc1)ccc(c2)/N=c/1\[nH]nc(c2c1cccc2)C

STL047770
Synonyms: 5- (diethylammonio)- 2- [(E)- (4H- 1,2,4- triazol- 4- ylimino)methyl]phenolate
Smiles: CC[NH+](c1ccc(c(c1)[O-])/C=N/n1cnnc1)CC

STL047775
Synonyms: (5Z)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]- 6- hydroxy- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C\C=C\c2ccco2)/C(=N1)O

STL047786
Synonyms: N'- (benzo[cd]indol- 2- yl)- 4- methylbenzohydrazide
Smiles: Cc1ccc(cc1)C(=O)NNC1=Nc2c3c1cccc3ccc2

STL047794
Synonyms: (5E)- 3- (2- fluorophenyl)- 6- hydroxy- 5- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C\NCCCN2CCOCC2)/C(=O)N1c1ccccc1F

STL047810
Synonyms: N- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]- 4- methyl- N- (3- nitrophenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)[N+](=O)[O-])CN1C(=NC(C1=O)(C)C)O

STL047838
Synonyms: methyl(3E)- 3- [(4- ethoxyphenyl)(hydroxy)methylidene]- 2- hydroxy- 4,5- dioxo- 1- phenylprolinate
Smiles: CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1(O)C(=O)OC)c1ccccc1)/O

STL047853
Synonyms: 5- (4- bromophenyl)- 7- (4- methoxyphenyl)- 3,7- dihydrotetrazolo[1,5- a]pyrimidine
Smiles: COc1ccc(cc1)C1C=C(N=c2n1nn[nH]2)c1ccc(cc1)Br

STL047866
Synonyms: 3- {[(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/c1cccc(c1)C(=O)O

STL047874
Synonyms: 1- [(2E)- 6- (methoxymethyl)- 4- oxo- 3,4- dihydropyrimidin- 2(1H)- ylidene]- 3- (4- methoxyphenyl)guanidine
Smiles: COCc1[nH]/c(=N\C(=N)Nc2ccc(cc2)OC)/[nH]c(=O)c1

STL047887
Synonyms: (5Z)- 5- (3- bromo- 4- methoxybenzylidene)- 3- (4- fluorobenzyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1Br)/C=C\1/C(=NC(=O)N(C1=O)Cc1ccc(cc1)F)O

STL047895
Synonyms: 3- ({(2E,5Z)- 5- [(1,2- dimethyl- 1H- indol- 3- yl)methylidene]- 4- oxo- 1,3- thiazolidin- 2- ylidene}amino)benzoicacid
Smiles: O=C1N/C(=N\c2cccc(c2)C(=O)O)/S/C/1=C\c1c(C)n(c2c1cccc2)C

STL047899
Synonyms: 8- methyl- 3- [5- (pyridin- 3- yl)- 1,2,4- oxadiazol- 3- yl]quinolin- 2(1H)- one
Smiles: O=c1[nH]c2c(cc1c1noc(n1)c1cccnc1)cccc2C

STL047903
Synonyms: 7- (ethylsulfanyl)- 5- methyl- 3- phenylpyrazolo[1,5- a]pyrimidine
Smiles: CCSc1cc(C)nc2n1ncc2c1ccccc1

STL047910
Synonyms: 3- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 6- (2,4,5- trimethoxyphenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(OC)c(cc1c1nn2c(s1)nnc2c1[nH]nc2c1CCC2)OC

STL047914
Synonyms: 2- (2,4- dichlorophenoxy)- N- (5- oxo- 7- phenyl- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)acetamide
Smiles: O=C(Nc1nn2c(=NC(=O)CC2c2ccccc2)[nH]1)COc1ccc(cc1Cl)Cl

STL047928
Synonyms: 5- [(E)- (3- chlorophenyl)diazenyl]- 2,6- dihydroxy- 4- methylpyridine- 3- carbonitrile
Smiles: N#Cc1c(O)nc(c(c1C)/N=N/c1cccc(c1)Cl)O

STL047940
Synonyms: N- [(2,2- diphenylethyl)carbamoyl]- L- leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)NCC(c1ccccc1)c1ccccc1)C

STL047942
Synonyms: ethyl4- {[(3,4- dimethylphenyl)sulfonyl]amino}- 5- methoxy- 1,2- dimethyl- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1c(NS(=O)(=O)c1ccc(c(c1)C)C)c(OC)cc2)C

STL047948
Synonyms: methyl3- ({(1E)- 1- [4- hydroxy- 2,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}amino)benzoate
Smiles: C=CCN1C(=O)N=C(/C(=C(\Nc2cccc(c2)C(=O)OC)/CC)/C1=O)O

STL047951
Synonyms: N- [7- (4- chlorophenyl)- 5- oxo- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]propanamide
Smiles: CCC(=O)Nc1nn2c(=NC(=O)CC2c2ccc(cc2)Cl)[nH]1

STL047956
Synonyms: 1- {2- [(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)amino]- 2- oxoethyl}- 3- phenyl- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: O=C(Cn1cc([n+]2c1CCC2)c1ccccc1)Nc1cc(=O)n(c(=O)n1C)C

STL047959
Synonyms: 1- {5- [(2- fluorobenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}- 2- methylpropan- 1- amine
Smiles: CC(C(c1nnc(o1)SCc1ccccc1F)N)C

STL047962
Synonyms: 2- (3- methylbutyl)- 2,3- dihydro- 1H- isoindole
Smiles: CC(CCN1Cc2c(C1)cccc2)C

STL047966
Synonyms: (2E)- 3- (2- chlorophenyl)- N- [7- (4- chlorophenyl)- 5- oxo- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]prop- 2- enamide
Smiles: O=C(Nc1nn2c(=NC(=O)CC2c2ccc(cc2)Cl)[nH]1)/C=C/c1ccccc1Cl

STL047972
Synonyms: (2Z)- 2- [(3- fluorophenyl)imino]- 6- (morpholin- 4- yl)- 5- nitro- 1,2- dihydropyrimidin- 4- amine
Smiles: Fc1cccc(c1)/N=c/1\nc(N)c(c([nH]1)N1CCOCC1)[N+](=O)[O-]

STL047974
Synonyms: 2- [(5- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1cc(C)nc2n1ncc2c1ccccc1

STL047975
Synonyms: N- [4- amino- 5- nitro- 6- (phenylamino)pyrimidin- 2- yl]glycine
Smiles: OC(=O)CNc1nc(Nc2ccccc2)c(c(n1)N)[N+](=O)[O-]

STL047979
Synonyms: methylN- [(2,5- dimethoxyphenyl)carbamoyl]leucinate
Smiles: COC(=O)C(NC(=O)Nc1cc(OC)ccc1OC)CC(C)C

STL047980
Synonyms: 5- {5- [(2- methylbenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}pentan- 1- amine
Smiles: NCCCCCc1nnc(o1)SCc1ccccc1C

STL047982
Synonyms: N- [(4- fluorobenzyl)carbamoyl]alanine
Smiles: CC(C(=O)O)NC(=O)NCc1ccc(cc1)F

STL047989
Synonyms: 2- [(6- chloro- 2- hydroxy- 4- phenylquinolin- 3- yl)sulfanyl]- N- (furan- 2- ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STL047992
Synonyms: 1- {5- [(2- fluorobenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}- 2- (1H- indol- 3- yl)ethanamine
Smiles: NC(c1nnc(o1)SCc1ccccc1F)Cc1c[nH]c2c1cccc2

STL047994
Synonyms: 4- {(E)- [(2,4- dihydroxypyrimidin- 5- yl)imino]methyl}- 2- methoxyphenylfuran- 2- carboxylate
Smiles: COc1cc(ccc1OC(=O)c1ccco1)/C=N/c1cnc(nc1O)O

STL047995
Synonyms: 1',6'- dimethyl- 2,6- dioxo- 1- 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)c1ccccc1)[O-]

STL047996
Synonyms: 9- fluoro- 3- methyl- 10- (4- methylpiperazin- 4- ium- 1- yl)- 7- oxo- 2,3- dihydro- 7H- [1,4]oxazino[2,3,4- ij]quinoline- 6- carboxylate
Smiles: C[NH+]1CCN(CC1)c1c(F)cc2c3c1OCC(n3cc(c2=O)C(=O)[O-])C

STL048004
Synonyms: (8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl4- nitrobenzoate
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])OCc1cc2cccc(c2[nH]c1=O)C

STL048005
Synonyms: (2Z)- 7- (4- chlorophenyl)- 2- [(3,5- dimethylphenyl)imino]- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: Clc1ccc(cc1)C1CC(=O)c2c(C1)[nH]/c(=N/c1cc(C)cc(c1)C)/nc2

STL048013
Synonyms: N- (1,3- benzodioxol- 5- ylcarbamoyl)alanine
Smiles: O=C(NC(C(=O)O)C)Nc1ccc2c(c1)OCO2

STL048026
Synonyms: (5Z)- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5- {[(furan- 2- ylmethyl)amino]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: SC1=NC(=O)/C(=C/NCc2ccco2)/C(=O)N1CCC1=CCCCC1

STL048027
Synonyms: 3- (4- bromobenzyl)- 5- nitro- 1H- indazole
Smiles: Brc1ccc(cc1)Cc1n[nH]c2c1cc(cc2)[N+](=O)[O-]

STL048029
Synonyms: N- [(3Z)- 1,7- dimethyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pyridine- 4- carboxamide
Smiles: Cc1ccc2c(c1)nc1c(c2)/c(=N/C(=O)c2ccncc2)/[nH]n1C

STL048036
Synonyms: 2- [4- (2- phenoxyethoxy)benzyl]- 1- azabicyclo[2.2.2]octan- 3- one
Smiles: O=C1C2CCN(C1Cc1ccc(cc1)OCCOc1ccccc1)CC2

STL048041
Synonyms: 6- {[4,6- di(piperidin- 1- yl)- 1,3,5- triazin- 2- yl]oxy}pyridazin- 3(2H)- one
Smiles: O=c1ccc(n[nH]1)Oc1nc(nc(n1)N1CCCCC1)N1CCCCC1

STL048042
Synonyms: methyl1- methyl- 6- nitro- 2- oxo- 1- (phenylcarbonyl)- 1,7b- dihydrocyclopropa[c]chromene- 1a(2H)- carboxylate
Smiles: COC(=O)C12C(=O)Oc3c(C1C2(C)C(=O)c1ccccc1)cc(cc3)[N+](=O)[O-]

STL048094
Synonyms: (5Z)- 1- (3- methylphenyl)- 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: Cc1cccc(c1)N1C(=NC(=O)/C(=C/NNc2[nH+]c3c(n2C)c(=O)n(c(=O)n3C)C)/C1=O)[S-]

STL048101
Synonyms: 1- [2- (furan- 2- ylmethyl)cyclohexyl]- 3- {2- [3- (prop- 1- en- 2- yl)phenyl]propan- 2- yl}urea
Smiles: O=C(NC(c1cccc(c1)C(=C)C)(C)C)NC1CCCCC1Cc1ccco1

STL048102
Synonyms: 8- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 4- oxo- 3- phenyl- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(c(c2=O)c1ccccc1)C(F)(F)F

STL048106
Synonyms: 2- benzyl- 12- (4- methoxyphenyl)- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 3- ium- 9- olate
Smiles: COc1ccc(cc1)C1c2ccc(cc2Oc2c1c1nc([nH+]n1cn2)Cc1ccccc1)[O-]

STL048108
Synonyms: [(3Z)- 3- (2- {[1- (4- ammonio- 1,2,5- oxadiazol- 3- yl)- 5- (2- chlorophenyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)- 2- oxo- 2,3- dihydro- 1H- indol- 1- yl]acetate
Smiles: [O-]C(=O)CN1c2ccccc2/C(=N/NC(=O)c2nnn(c2c2ccccc2Cl)c2nonc2[NH3+])/C1=O

STL048109
Synonyms: 4- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1c1n[nH]c(c1)c1ccccc1

STL048111
Synonyms: N- (5- oxo- 7- phenyl- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)propanamide
Smiles: CCC(=O)Nc1[nH]c2=NC(=O)CC(n2n1)c1ccccc1

STL048117
Synonyms: 8- amino- 5- hydroxy- 2- (methylamino)- 6- phenyl- 6H- pyrano[2,3- d][1,3]thiazolo[4,5- b]pyridine- 7- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1)c(O)nc1c2sc(n1)NC

STL048120
Synonyms: 4- {4- [2- (naphthalen- 1- yloxy)ethyl]piperazin- 1- yl}- 4- oxo- N- [(2Z)- 5- (propan- 2- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]butanamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C(C)C)CCC(=O)N1CCN(CC1)CCOc1cccc2c1cccc2

STL048133
Synonyms: 2- [4- (2,5- dichlorophenoxy)quinazolin- 1- ium- 2- yl]phenolate
Smiles: Clc1ccc(c(c1)Oc1nc([nH+]c2c1cccc2)c1ccccc1[O-])Cl

STL048134
Synonyms: 3- (benzylammonio)- 4- [(2- bromophenyl)amino]- 4- oxobutanoate
Smiles: [O-]C(=O)CC(C(=O)Nc1ccccc1Br)[NH2+]Cc1ccccc1

STL048139
Synonyms: (2Z)- 3- [4- (carboxymethoxy)phenyl]- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: [O-]C(=O)/C(=C/c1ccc(cc1)OCC(=O)O)/Sc1[nH]nc([nH+]1)C

STL048140
Synonyms: (4Z)- 4- (phenylimino)- 6- [(4- phenylpiperazin- 1- yl)methyl]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1nc(CN2CCN(CC2)c2ccccc2)[nH]/c(=N/c2ccccc2)/n1

STL048141
Synonyms: 2- {5- [(E)- (1- cyclopropyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]- 2,4- dimethoxybenzyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1cc(OC)c(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C/1\C(=O)N=C(N(C1=O)C1CC1)S

STL048153
Synonyms: N,N- diethyl- N'- (2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)ethane- 1,2- diamine
Smiles: CCN(CCNc1nc(CC)nc2c1oc1c2cccc1)CC

STL048161
Synonyms: 3- [5- (2- fluorophenyl)- 1,2,4- oxadiazol- 3- yl]- 6- methoxyquinolin- 2(1H)- one
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)c1noc(n1)c1ccccc1F

STL048164
Synonyms: (2Z)- 7- (4- fluorophenyl)- 2- [(4- fluorophenyl)imino]- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: Fc1ccc(cc1)/N=c/1\ncc2c([nH]1)CC(CC2=O)c1ccc(cc1)F

STL048170
Synonyms: 3- [4- (3- ethoxyphenoxy)butyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCOc1cccc(c1)OCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STL048171
Synonyms: N- [(4E)- [1]benzofuro[3,2- d]pyrimidin- 4(3H)- ylidene]- 4- chloroaniline
Smiles: Clc1ccc(cc1)/N=c\1/[nH]cnc2c1oc1c2cccc1

STL048173
Synonyms: 5- {[(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nnc(s1)SCc1cc(O)n2c(n1)ncn2

STL048175
Synonyms: N- {[2- (4- chlorophenyl)ethyl]carbamoyl}methionine
Smiles: CSCCC(C(=O)O)NC(=O)NCCc1ccc(cc1)Cl

STL048181
Synonyms: N- (2- methoxyethyl)- 2- phenyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: COCCNc1nc(nc2c1oc1c2cccc1)c1ccccc1

STL048187
Synonyms: 2- ethyl- N- (propan- 2- yl)[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: CCc1nc(NC(C)C)c2c(n1)c1ccccc1o2

STL048192
Synonyms: 4- (4- benzylpiperazin- 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)Cc2ccccc2)/s1

STL048203
Synonyms: (5E)- 6- hydroxy- 5- ({[2- (4- methoxyphenyl)ethyl]amino}methylidene)- 3- methylpyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)CCN/C=C/1\C(=NC(=O)N(C1=O)C)O

STL048212
Synonyms: 4- hydroxy- 6,7- dimethoxy- N- [3- (4- methylpiperazin- 1- yl)propyl]- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: COc1cc2c(cc1OC)[nH]c(=O)c(c2O)C(=O)NCCCN1CCN(CC1)C

STL048215
Synonyms:
Smiles: COCCCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc2c1nsn2

STL048223
Synonyms: 2- [7- (4- chlorophenyl)- 1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydro- 8H- imidazo[2,1- f]purin- 9- ium- 8- yl]phenolate
Smiles: Clc1ccc(cc1)c1cn2c(n1c1ccccc1[O-])[nH+]c1c2c(=O)n(C)c(=O)n1C

STL048231
Synonyms: 3- {[(5- chlorothiophen- 2- yl)sulfonyl]amino}- 1H- indole- 2- carboxylicacid
Smiles: Clc1ccc(s1)S(=O)(=O)Nc1c([nH]c2c1cccc2)C(=O)O

STL048232
Synonyms: N'- [(Z)- (1- cyclohexyl- 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)C1CCCCC1)S

STL048235
Synonyms: N- [(3Z)- 8- methyl- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pyridine- 4- carboxamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)c2ccncc2)/c2c1nc1c(C)cccc1c2)C

STL048242
Synonyms: (2Z)- 3- (5- bromo- 2,4- dimethoxyphenyl)- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: COc1cc(OC)c(cc1/C=C(/C(=O)[O-])\Sc1[nH]nc([nH+]1)C)Br

STL048244
Synonyms: 3- (benzylammonio)- 4- {[4- (diethylamino)phenyl]amino}- 4- oxobutanoate
Smiles: CCN(c1ccc(cc1)NC(=O)C(CC(=O)[O-])[NH2+]Cc1ccccc1)CC

STL048249
Synonyms: N- [(3Z)- 6- methyl- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pyridine- 4- carboxamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)c2ccncc2)/c2c1nc1ccc(cc1c2)C)C

STL048257
Synonyms: 6- methyl- 5- ({[5- (pyrrolidin- 2- yl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}methyl)pyrimidine- 2,4(1H,3H)- dione
Smiles: Cc1[nH]c(=O)[nH]c(=O)c1CSc1nnc(o1)C1CCCN1

STL048258
Synonyms: 4- [(4- chlorophenyl)amino]- 4- oxo- 3- (piperidinium- 1- yl)butanoate
Smiles: O=C(C([NH+]1CCCCC1)CC(=O)[O-])Nc1ccc(cc1)Cl

STL048259
Synonyms: 3- {[1- (2,3- dimethoxyphenyl)but- 3- en- 1- yl]amino}propan- 1- ol
Smiles: COc1c(C(NCCCO)CC=C)cccc1OC

STL048260
Synonyms: tert- butyl[1- (5- {[(2,4- dihydroxy- 6- methylpyrimidin- 5- yl)methyl]sulfanyl}- 1,3,4- oxadiazol- 2- yl)- 3- (methylsulfanyl)propyl]carbamate
Smiles: CSCCC(c1nnc(o1)SCc1c(C)nc(nc1O)O)NC(=O)OC(C)(C)C

STL048270
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 3- methyl- 1- (4- methylphenyl)- 4,6- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7- ol
Smiles: OC1=Nc2c(C(SC1)c1ccc3c(c1)OCO3)c(nn2c1ccc(cc1)C)C

STL048280
Synonyms: (5E)- 5- {[1- (3- chloropropyl)- 2,3- dihydro- 1H- indol- 5- yl]methylidene}- 3- cyclohexyl- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C/1\C(=NC(=O)N(C1=O)C1CCCCC1)O

STL048285
Synonyms: 6- propyl- 2- [(4,6,7- trimethylquinazolin- 2- yl)amino]pyrimidin- 4- ol
Smiles: CCCc1nc(nc(c1)O)Nc1nc(C)c2c(n1)cc(c(c2)C)C

STL048287
Synonyms: 2- {[5- (1- amino- 2- phenylethyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- N,N- diethylacetamide
Smiles: CCN(C(=O)CSc1nnc(o1)C(Cc1ccccc1)N)CC

STL048289
Synonyms: 3- methyl- N- (3- methylphenyl)- N- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]benzamide
Smiles: Cc1cccc(c1)N(C(=O)c1cccc(c1)C)Cc1cc(=O)[nH]c2c1cccc2

STL048291
Synonyms: 2,12- diphenyl- 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)c1ccccc1

STL048294
Synonyms: N- [(2Z)- 3- [(3- methoxypropyl)amino]quinoxalin- 2(1H)- ylidene]- 4- methylbenzenesulfonamide
Smiles: COCCCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)C

STL048296
Synonyms: 2- (1H- indol- 3- yl)- 1- {5- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}ethanamine
Smiles: CC(=C)CSc1nnc(o1)C(Cc1c[nH]c2c1cccc2)N

STL048297
Synonyms: 8- (dimethylamino)- 6- hydroxy- 3- methyl- 7- (2- oxo- 2- phenylethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN(c1nc2c(n1CC(=O)c1ccccc1)c(O)nc(=O)n2C)C

STL048300
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (2- methoxy- 5- 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: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(C)cc2C)[N+](=O)[O-]

STL048304
Synonyms: 5- amino- 2- (1,3- benzothiazol- 3- ium- 2- yl)phenolate
Smiles: Nc1ccc(c(c1)[O-])c1sc2c([nH+]1)cccc2

STL048312
Synonyms: (2Z)- 3- (3- chloro- 4- fluorophenyl)- 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(c(c1)Cl)F)O

STL048313
Synonyms: N- cyclooctyl- N'- [(2Z)- 5- (propan- 2- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]butanediamide
Smiles: O=C(NC1CCCCCCC1)CCC(=O)/N=c\1/[nH]nc(s1)C(C)C

STL048314
Synonyms: (2Z)- 3- (2,4- dimethoxyphenyl)- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: COc1cc(OC)ccc1/C=C(/C(=O)[O-])\Sc1[nH]nc([nH+]1)C

STL048316
Synonyms: 1- [5- (benzylsulfanyl)- 1,3,4- oxadiazol- 2- yl]- 2- phenylethanamine
Smiles: NC(c1nnc(o1)SCc1ccccc1)Cc1ccccc1

STL048321
Synonyms: 6'- amino- 5- chloro- 3'- ethyl- 2- oxo- 1,2- dihydro- 2'H- spiro[indole- 3,4'- pyrano[2,3- c]pyrazole]- 5'- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(Cl)cc1)c(CC)[nH]n2

STL048326
Synonyms: (5E)- 6- hydroxy- 5- (1- {[3- (1H- imidazol- 1- yl)propyl]amino}propylidene)- 3- (4- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/NCCCn1cncc1

STL048338
Synonyms: (4E)- 4- [(4- bromophenyl)(hydroxy)methylidene]- 1- (pyridin- 2- yl)- 5- (pyridin- 3- yl)pyrrolidine- 2,3- dione
Smiles: Brc1ccc(cc1)/C(=C\1/C(c2cccnc2)N(C(=O)C1=O)c1ccccn1)/O

STL048340
Synonyms: (2Z)- 2- [(3- chlorophenyl)imino]- N~6~- (3- fluorophenyl)- 5- nitro- 1,2- dihydropyrimidine- 4,6- diamine
Smiles: Fc1cccc(c1)Nc1[nH]/c(=N/c2cccc(c2)Cl)/nc(c1[N+](=O)[O-])N

STL048343
Synonyms: 3- (4- chlorophenyl)- 8- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(c(c2=O)c1ccc(cc1)Cl)C(F)(F)F

STL048350
Synonyms: N- [3- (furan- 2- yl)- 4- phenylbutyl]- 2- methyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: Cc1nc(NCCC(c2ccco2)Cc2ccccc2)c2c(n1)c1ccccc1o2

STL048361
Synonyms: (1E)- 1- [(4- methoxyphenyl)imino]- 3- methyl- 2- (4- methylbenzyl)- 1,5- dihydropyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c(C)c(Cc2ccc(cc2)C)/c(=N\c2ccc(cc2)OC)/n2c1[nH]c1c2cccc1

STL048364
Synonyms: 4- [4- (5- chloro- 2- methoxybenzyl)piperazin- 1- yl]- N- [(2Z)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxobutanamide
Smiles: COc1ccc(cc1CN1CCN(CC1)C(=O)CCC(=O)/N=c\1/[nH]nc(s1)CC(C)C)Cl

STL048365
Synonyms: (2E)- 3- (3- ethoxy- 4- methoxyphenyl)- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: CCOc1cc(ccc1OC)/C=C(\C(=O)[O-])/Sc1[nH]nc([nH+]1)C

STL048366
Synonyms: 8- [(2Z)- 2- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)hydrazinyl]- 6- hydroxy- 7- [2- hydroxy- 3- (propan- 2- yloxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(OCC(Cn1c(N/N=C\2/C(=NC(=NC2=O)O)O)nc2c1c(O)nc(=O)n2C)O)C

STL048370
Synonyms: 4- {4- [(4- fluorophenyl)sulfonyl]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)S(=O)(=O)c2ccc(cc2)F)/s1

STL048373
Synonyms: N,N- diethyl- N'- (2- phenyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)ethane- 1,2- diamine
Smiles: CCN(CCNc1nc(nc2c1oc1c2cccc1)c1ccccc1)CC

STL048375
Synonyms: (5E)- 5- {1- [(1- benzylpiperidinium- 4- yl)amino]propylidene}- 2- hydroxy- 6- oxo- 5,6- dihydropyrimidin- 4- olate
Smiles: CC/C(=C\1/C(=NC(=NC1=O)O)[O-])/NC1CC[NH+](CC1)Cc1ccccc1

STL048376
Synonyms: 6- amino- 4- (4- hydroxyphenyl)- 3- (3- methoxyphenyl)- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: COc1cccc(c1)c1[nH]nc2c1C(c1ccc(cc1)O)C(=C(O2)N)C#N

STL048378
Synonyms: 8- bromo- 6- hydroxy- 3- methyl- 7- {2- [(4- methylpyrimidin- 2- yl)sulfanyl]ethyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1ccnc(n1)SCCn1c(Br)nc2c1c(O)nc(=O)n2C

STL048382
Synonyms: 2- [(E)- {2- [(4- nitro- 1H- pyrazol- 2- ium- 1- yl)acetyl]hydrazinylidene}methyl]phenolate
Smiles: O=C(Cn1[nH+]cc(c1)[N+](=O)[O-])N/N=C/c1ccccc1[O-]

STL048400
Synonyms: ethyl{(5E)- 5- [(cyclohexylcarbonyl)imino]- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl}acetate
Smiles: CCOC(=O)Cc1n[nH]/c(=N\C(=O)C2CCCCC2)/s1

STL048407
Synonyms: 4,7- dihydroxy- 1- (2- methylpropyl)- 5,5- bis(trifluoromethyl)- 5,6- dihydropyrimido[4,5- d]pyrimidin- 2(1H)- one
Smiles: CC(Cn1c(=O)nc(c2c1N=C(O)NC2(C(F)(F)F)C(F)(F)F)O)C

STL048413
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1O)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STL048426
Synonyms: N,N- diethyl- 2- (2- nitro- 10H- indolo[3,2- b]quinolin- 10- yl)ethanamine
Smiles: CCN(CCn1c2ccccc2c2c1cc1cc(ccc1n2)[N+](=O)[O-])CC

STL048428
Synonyms: N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (propan- 2- yl)furan- 2- carboxamide
Smiles: CC(N(C(=O)c1ccco1)Cc1cc2ccccc2[nH]c1=O)C

STL048429
Synonyms: N- [(3Z)- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pyridine- 4- carboxamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)c2ccncc2)/c2c1nc1ccccc1c2)C

STL048452
Synonyms: 3- (5- tert- butyl- 1,2,4- oxadiazol- 3- yl)- 6- methylquinolin- 2(1H)- one
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)c1noc(n1)C(C)(C)C

STL048453
Synonyms: 3- [5- (propan- 2- yl)- 1,2,4- oxadiazol- 3- yl]quinolin- 2(1H)- one
Smiles: CC(c1onc(n1)c1cc2ccccc2[nH]c1=O)C

STL048467
Synonyms: N- (4- methoxyphenyl)- N- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]acetamide
Smiles: COc1ccc(cc1)N(C(=O)C)Cc1cc(=O)[nH]c2c1cccc2

STL048473
Synonyms: 8- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 6- hydroxy- 7- (2- hydroxyethyl)- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCn1c(N/N=C/c2ccc(cc2)F)nc2c1c(O)nc(=O)n2C

STL048476
Synonyms: 4- amino- 2- [5- (propan- 2- yl)- 1,3- benzoxazol- 3- ium- 2- yl]phenolate
Smiles: Nc1ccc(c(c1)c1oc2c([nH+]1)cc(cc2)C(C)C)[O-]

STL048494
Synonyms: (5Z)- 6- hydroxy- 5- (2- {6- hydroxy- 7- [2- hydroxy- 3- (4- methoxyphenoxy)propyl]- 3- methyl- 2- oxo- 3,7- dihydro- 2H- purin- 8- yl}hydrazinylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)OCC(Cn1c(N/N=C/2\C(=O)NC(=O)N=C2O)nc2c1c(O)nc(=O)n2C)O

STL048505
Synonyms: N'- [(1Z)- 1- (1- benzyl- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)ethyl]- 2- chlorobenzohydrazide
Smiles: O=C1N=C(O)/C(=C(/NNC(=O)c2ccccc2Cl)\C)/C(=O)N1Cc1ccccc1

STL048508
Synonyms: N- [(2Z)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxo- 4- (pyrrolidin- 1- yl)butanamide
Smiles: CCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCCC2)/s1

STL048509
Synonyms: 9a- [(E)- 2- (2- fluorophenyl)ethenyl]- 7,9,9- trimethyl- 9,9a- dihydro- 1H- imidazo[1,2- a]indol- 2(3H)- one
Smiles: O=C1CN2C(N1)(/C=C/c1ccccc1F)C(c1c2ccc(c1)C)(C)C

STL048514
Synonyms: 4- [(E)- {[3- (2- fluorophenyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]imino}methyl]benzoicacid
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(=O)O

STL048515
Synonyms: ethyl4- (3- methyl- 6- oxo- 4- phenyl- 2,6- dihydropyrrolo[3,4- c]pyrazol- 5(4H)- yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)c2c(C1c1ccccc1)c([nH]n2)C

STL048517
Synonyms: 7- benzyl- 8- [(furan- 2- ylmethyl)amino]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1n(Cc1ccccc1)c(n2)NCc1ccco1)C

STL048564
Synonyms: pyridine- 2,6- diyldimethanediylbis(methylcarbamate)
Smiles: CNC(=O)OCc1cccc(n1)COC(=O)NC

STL048574
Synonyms: methylN- [(2,4- dimethoxybenzyl)carbamoyl]leucinate
Smiles: COC(=O)C(NC(=O)NCc1ccc(cc1OC)OC)CC(C)C

STL048589
Synonyms: 8- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 6- hydroxy- 3- methyl- 7- propyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCn1c(N/N=C/c2ccc(cc2)F)nc2c1c(O)nc(=O)n2C

STL048593
Synonyms: 2- {[5- (2- aminoethyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- N- (2,6- dimethylphenyl)acetamide
Smiles: NCCc1nnc(o1)SCC(=O)Nc1c(C)cccc1C

STL048606
Synonyms: N- {[4- (4- fluorophenyl)piperazin- 1- yl]carbonyl}phenylalanine
Smiles: OC(=O)C(NC(=O)N1CCN(CC1)c1ccc(cc1)F)Cc1ccccc1

STL048610
Synonyms: 3- chloro- N- [(2E)- 5- [2- (piperidin- 1- yl)ethyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: Clc1cccc(c1)C(=O)/N=c/1\[nH]nc(s1)CCN1CCCCC1

STL048634
Synonyms: 3- (2,6- dichlorophenyl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- imine5,5- dioxide
Smiles: N=C1SC2C(N1c1c(Cl)cccc1Cl)CS(=O)(=O)C2

STL048637
Synonyms: methyl3- {[(1E)- 1- (1- benzyl- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)propyl]amino}benzoate
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O)/Nc1cccc(c1)C(=O)OC

STL048650
Synonyms: N- (3- butyl- 2- hydroxy- 7- methyl- 4- oxo- 3,4- dihydrobenzo[g]pteridin- 8- yl)- 2,2,2- trifluoroacetamide
Smiles: CCCCn1c(O)nc2c(c1=O)nc1c(n2)cc(c(c1)C)NC(=O)C(F)(F)F

STL048662
Synonyms: (11E)- 11- [(4- butylphenyl)imino]- 5,7,8,9,10,11- hexahydrobenzimidazo[1,2- b]isoquinoline- 6- carbonitrile
Smiles: CCCCc1ccc(cc1)/N=c/1\c2CCCCc2c(c2n1c1ccccc1[nH]2)C#N

STL048668
Synonyms: 2- methoxy- N- [(2Z)- 5- (4- methoxybenzyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: COc1ccc(cc1)Cc1n[nH]/c(=N/C(=O)c2ccccc2OC)/s1

STL048669
Synonyms: 4- {[(3Z)- 3- {[(4- methoxyphenyl)sulfonyl]imino}- 3,4- dihydroquinoxalin- 2- yl]amino}benzoicacid
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(cc1)C(=O)O

STL048671
Synonyms: (2Z)- 6- (4- benzylpiperazin- 1- yl)- 2- [(3,4- dimethylphenyl)imino]- 5- nitro- 1,2- dihydropyrimidin- 4- amine
Smiles: [O-][N+](=O)c1c(N)n/c(=N\c2ccc(c(c2)C)C)/[nH]c1N1CCN(CC1)Cc1ccccc1

STL048676
Synonyms: tert- butyl[(1S)- 1- {5- [(3,4- dichlorobenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}ethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)S(=O)(=O)Cc1ccc(c(c1)Cl)Cl)C

STL048682
Synonyms: 2- (1H- indol- 3- yl)- 1- {5- [(2- methylbenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}ethanamine
Smiles: NC(c1nnc(o1)SCc1ccccc1C)Cc1c[nH]c2c1cccc2

STL048685
Synonyms: azepan- 1- yl[1- (furan- 2- ylmethyl)piperidin- 3- yl]methanone
Smiles: O=C(N1CCCCCC1)C1CCCN(C1)Cc1ccco1

STL048694
Synonyms: (E)- {1- ethyl- 1'- [3- (morpholin- 4- ium- 4- yl)propyl]- 2,4',5'- trioxo- 1,2- dihydro- 3'H- spiro[indole- 3,2'- pyrrolidin]- 3'- ylidene}(5- methylfuran- 2- yl)methanolate
Smiles: CCN1c2ccccc2C2(C1=O)N(CCC[NH+]1CCOCC1)C(=O)C(=O)/C/2=C(\c1ccc(o1)C)/[O-]

STL048695
Synonyms: methyl2- amino- 5- hydroxy- 7- methyl- 4- (pyridin- 3- yl)- 4H- pyrano[3,2- c]pyridine- 3- carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C1c1cccnc1)c(O)nc(c2)C

STL048709
Synonyms: N- [(2E)- 5- (2- methoxyphenyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- (3- methylphenoxy)acetamide
Smiles: COc1ccccc1c1n[nH]/c(=N\C(=O)COc2cccc(c2)C)/s1

STL048716
Synonyms: 2- {[5- (1- amino- 2- methylbutyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}acetamide
Smiles: CCC(C(c1nnc(o1)SCC(=O)N)N)C

STL048718
Synonyms: 5- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}pyrimidine- 2,4- diol
Smiles: COc1cc(/C=N/c2cnc(nc2O)O)ccc1OC

STL048721
Synonyms: N- [(3Z)- 1- ethyl- 8- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pyridine- 2- carboxamide
Smiles: CCn1[nH]/c(=N\C(=O)c2ccccn2)/c2c1nc1c(c2)cccc1C

STL048730
Synonyms: 4H- benzo[b]pyrazolo[3,4- h][1,6]naphthyridin- 1- amine
Smiles: Nc1nnc2c1c1nc3ccccc3cc1c[nH]2

STL048740
Synonyms: 4- [2- (3- nitrophenyl)- 5- (4- nitrophenyl)- 4,6- dioxohexahydro- 2H- pyrrolo[3,4- d][1,2]oxazol- 3- yl]phenyl4- chloro- 1- methyl- 1H- pyrazole- 5- carboxylate
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)C2C1C(c1ccc(cc1)OC(=O)c1c(Cl)cnn1C)N(O2)c1cccc(c1)[N+](=O)[O-]

STL048753
Synonyms: N- [(2E)- 6- sulfamoyl- 1,3- benzothiazol- 2(3H)- ylidene]thiophene- 2- carboxamide
Smiles: O=C(c1cccs1)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N

STL048758
Synonyms: 6'- amino- 1,3- dimethyl- 3'- propyl- 2'H- spiro[piperidine- 4,4'- pyrano[2,3- c]pyrazole]- 5'- carbonitrile
Smiles: CCCc1[nH]nc2c1C1(CCN(CC1C)C)C(=C(O2)N)C#N

STL048761
Synonyms: (5Z)- 3- [2- (3,4- dimethoxyphenyl)ethyl]- 6- hydroxy- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cc(CCN2C(=O)N=C(/C(=C/NCCCn3cncc3)/C2=O)O)ccc1OC

STL048766
Synonyms: 2- methyl- 5- (1- methyl- 1H- benzimidazol- 3- ium- 2- yl)furan- 3- sulfonate
Smiles: Cn1c([nH+]c2c1cccc2)c1oc(c(c1)S(=O)(=O)[O-])C

STL048767
Synonyms: ethyl2- methyl- 9- propyl- 9H- imidazo[1,2- a]benzimidazole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)nc2n1c1ccccc1n2CCC

STL048776
Synonyms: {(3E)- 2- (4- fluorophenyl)- 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)F

STL048779
Synonyms: (5E)- 5- (1- {[3- (dimethylamino)propyl]amino}propylidene)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C/1\C(=O)NC(=O)N=C1O)/NCCCN(C)C

STL048784
Synonyms: 2- [(3,4- dichlorobenzyl)sulfanyl]- 5- (pyrrolidin- 2- yl)- 1,3,4- oxadiazole
Smiles: Clc1ccc(cc1Cl)CSc1nnc(o1)C1CCCN1

STL048792
Synonyms: 2- {[5- (5- aminopentyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- N- (4- bromophenyl)acetamide
Smiles: NCCCCCc1nnc(o1)SCC(=O)Nc1ccc(cc1)Br

STL048793
Synonyms: 4- chloro- 2- [4- (4- fluorophenyl)- 6- phenylpyridinium- 2- yl]phenolate
Smiles: Fc1ccc(cc1)c1cc([nH+]c(c1)c1cc(Cl)ccc1[O-])c1ccccc1

STL048797
Synonyms: 1- (2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)piperidine- 4- carboxylicacid
Smiles: CCc1nc(N2CCC(CC2)C(=O)O)c2c(n1)c1ccccc1o2

STL048804
Synonyms: 5- acetyl- 3- hexyl- 2- hydroxy- 6- oxo- 3,6- dihydropyrimidin- 4- olate
Smiles: CCCCCCn1c(O)nc(=O)c(c1[O-])C(=O)C

STL048805
Synonyms: methyl{2- [(4- ethoxyphenyl)amino]- 6- hydroxypyrimidin- 4- yl}acetate
Smiles: CCOc1ccc(cc1)Nc1nc(O)cc(n1)CC(=O)OC

STL048813
Synonyms: 4- {[(E)- naphthalen- 1- ylmethylidene]amino}- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1/N=C/c1cccc2c1cccc2)c1[nH]nc2c1CCC2

STL048818
Synonyms: (5E)- 6- hydroxy- 5- (1- {[2- (morpholin- 4- yl)ethyl]amino}propylidene)- 3- phenylpyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1)O)/NCCN1CCOCC1

STL048822
Synonyms: methylN- ({4- [(E)- 2- phenylethenyl]piperazin- 1- yl}carbonyl)valinate
Smiles: COC(=O)C(C(C)C)NC(=O)N1CCN(CC1)/C=C/c1ccccc1

STL048827
Synonyms: N- (3- chloro- 4- methylphenyl)- 6- hydroxy- 2- (piperidin- 1- yl)- 4,5- dihydropyrimidine- 4- carboxamide
Smiles: O=C(C1CC(=NC(=N1)N1CCCCC1)O)Nc1ccc(c(c1)Cl)C

STL048829
Synonyms: 3- (4- bromophenyl)- 4- oxo- 8- (pyrrolidinium- 1- ylmethyl)- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: Brc1ccc(cc1)c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCCC1)[O-]

STL048837
Synonyms: 2,4- dichloro- N- [(2Z)- 5- (1H- indol- 3- ylmethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)/N=c\1/[nH]nc(s1)Cc1c[nH]c2c1cccc2

STL048841
Synonyms: N- [(2Z)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxo- 4- [4- (phenylsulfonyl)piperazin- 1- yl]butanamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)/s1)C

STL048842
Synonyms: 6- chloro- 3- [(1Z)- 2- hydroxy- 4- methylpent- 1- en- 1- yl]- 2H- 1,4- benzoxazin- 2- one
Smiles: CC(C/C(=C/c1nc2cc(Cl)ccc2oc1=O)/O)C

STL048847
Synonyms: (5E)- 5- {1- [(2,4- dimethoxyphenyl)amino]propylidene}- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: COc1ccc(c(c1)OC)N/C(=C/1\C(=NC(=NC1=O)O)O)/CC

STL048855
Synonyms: 6- (4- bromophenyl)- 7- (4- fluorophenyl)- 7,12- dihydro- 6H- chromeno[4,3- d][1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Fc1ccc(cc1)C1C2=C(Nc3n1ncn3)c1c(OC2c2ccc(cc2)Br)cccc1

STL048858
Synonyms: ethyl[(5E)- 5- {[(3- nitrophenyl)carbonyl]imino}- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]acetate
Smiles: CCOC(=O)Cc1n[nH]/c(=N\C(=O)c2cccc(c2)[N+](=O)[O-])/s1

STL048863
Synonyms: 2- [4- (2- chlorophenoxy)quinazolin- 1- ium- 2- yl]phenolate
Smiles: Clc1ccccc1Oc1nc([nH+]c2c1cccc2)c1ccccc1[O-]

STL048870
Synonyms: 3- (propan- 2- yl)- 7,8,9,10- tetrahydrothieno[2',3':4,5]pyrimido[1,2- a]azepin- 4(6H)- one
Smiles: CC(c1csc2c1c(=O)n1c(n2)CCCCC1)C

STL048880
Synonyms: 1- [2- (2- chlorophenyl)- 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)c1ccccc1Cl

STL048888
Synonyms: 6- methoxy- 3- (5- phenyl- 1,2,4- oxadiazol- 3- yl)quinolin- 2(1H)- one
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)c1noc(n1)c1ccccc1

STL048890
Synonyms: 6- (5- bromofuran- 2- yl)- 3- (5- phenyl- 1H- pyrazol- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Brc1ccc(o1)c1sc2n(n1)c(nn2)c1n[nH]c(c1)c1ccccc1

STL048891
Synonyms: N- [(2Z)- 5- (propan- 2- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- N'- (thiophen- 2- ylmethyl)butanediamide
Smiles: O=C(NCc1cccs1)CCC(=O)/N=c\1/[nH]nc(s1)C(C)C

STL048895
Synonyms: (5E)- 3- benzyl- 5- {1- [(4- fluorobenzyl)amino]ethylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Fc1ccc(cc1)CN/C(=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)/C

STL048897
Synonyms: 3- ({(E)- [1- (butan- 2- yl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}amino)benzoicacid
Smiles: CCC(N1C(=NC(=O)/C(=C\Nc2cccc(c2)C(=O)O)/C1=O)S)C

STL048899
Synonyms: N- [(2E)- 5- (3,4- dimethoxyphenyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- (2- methoxyphenoxy)acetamide
Smiles: COc1cc(ccc1OC)c1n[nH]/c(=N\C(=O)COc2ccccc2OC)/s1

STL048903
Synonyms: 6- (naphthalen- 2- yl)- 3- (5- phenyl- 1H- pyrazol- 3- yl)- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine
Smiles: c1ccc(cc1)c1[nH]nc(c1)c1nnc2n1N=C(CS2)c1ccc2c(c1)cccc2

STL048906
Synonyms: methylN- (1,2,3,4- tetrahydronaphthalen- 1- ylcarbamoyl)leucinate
Smiles: COC(=O)C(NC(=O)NC1CCCc2c1cccc2)CC(C)C

STL048924
Synonyms: {2- (4- fluorophenyl)- 1- (4- methylphenyl)- 4- [(4- methylphenyl)ammonio]- 5- oxo- 2,5- dihydro- 1H- pyrrol- 3- yl}acetate
Smiles: Cc1ccc(cc1)[NH2+]C1=C(CC(=O)[O-])C(N(C1=O)c1ccc(cc1)C)c1ccc(cc1)F

STL048925
Synonyms: N- [(2E)- 5- [(E)- 2- (4- methoxyphenyl)ethenyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- methylpropanamide
Smiles: COc1ccc(cc1)/C=C/c1n[nH]/c(=N\C(=O)C(C)C)/s1

STL048932
Synonyms: 9- (3,5- dimethylphenyl)- 4- hydroxy- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purin- 2(1H)- one
Smiles: Cc1cc(C)cc(c1)N1CCCn2c1nc1c2c(O)nc(=O)n1C

STL048935
Synonyms: 5- [(1E)- N- (4- ethoxyphenyl)propanimidoyl]- 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)\CC

STL048940
Synonyms: 4- {[(1E,2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]amino}- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1/N=C/C=C/c1ccco1)c1n[nH]c(c1)c1ccccc1

STL048947
Synonyms: 1- cyclopropyl- 6- fluoro- 8- methoxy- 7- (3- methylpiperazin- 4- ium- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxylate
Smiles: COc1c(N2CC[NH2+]C(C2)C)c(F)cc2c1n(cc(c2=O)C(=O)[O-])C1CC1

STL048951
Synonyms: ethyl{[5- (1- amino- 2- phenylethyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc(o1)C(Cc1ccccc1)N

STL048959
Synonyms: (2- {[(2E)- 6- chloro- 1,3- benzothiazol- 2(3H)- ylidene]amino}- 2- oxoethyl)phosphonicacid
Smiles: Clc1ccc2c(c1)s/c(=N/C(=O)CP(=O)(O)O)/[nH]2

STL048963
Synonyms: (5E)- 5- {[(2- aminophenyl)amino]methylidene}- 1- (butan- 2- yl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCC(N1C(=NC(=O)/C(=C\Nc2ccccc2N)/C1=O)S)C

STL048970
Synonyms: (5E)- 6- hydroxy- 5- {[(4- hydroxy- 6- methylpyrimidin- 2- yl)amino]methylidene}- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C/Nc2nc(C)cc(n2)O)/C(=N1)O

STL048971
Synonyms: N- [4- hydroxy- 2,6- dioxo- 1- (2- phenylethyl)- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]acetamide
Smiles: CC(=O)NC1(C(=O)Nc2c1c(O)nc(=O)n2CCc1ccccc1)C(F)(F)F

STL048979
Synonyms: (5Z)- 1- cycloheptyl- 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)N1C1CCCCCC1

STL048993
Synonyms: methyl2- amino- 4- (4- chlorophenyl)- 5- hydroxy- 7- methyl- 4H- pyrano[3,2- c]pyridine- 3- carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C1c1ccc(cc1)Cl)c(O)nc(c2)C

STL048994
Synonyms: 5- [(1E)- N- (3- fluorophenyl)ethanimidoyl]- 6- hydroxy- 1,3- dimethylpyrimidine- 2,4(1H,3H)- dione
Smiles: Fc1cccc(c1)/N=C(/c1c(O)n(C)c(=O)n(c1=O)C)\C

STL049002
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 6- hydroxy- 3- methyl- 7- [2- (pyrimidin- 2- ylsulfanyl)ethyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCN1CCN(CC1)c1nc2c(n1CCSc1ncccn1)c(O)nc(=O)n2C

STL049003
Synonyms: N- [(3Z)- 1- ethyl- 7- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 3- methylbutanamide
Smiles: CCn1[nH]/c(=N\C(=O)CC(C)C)/c2c1nc1cc(C)ccc1c2

STL049027
Synonyms: 4- {4- [(4- methoxyphenyl)sulfonyl]piperazin- 1- yl}- 4- oxo- N- [(2Z)- 5- (trifluoromethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]butanamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)CCC(=O)/N=c\1/[nH]nc(s1)C(F)(F)F

STL049028
Synonyms: 1- {2- [(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)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)Nc1cc(=O)n(c(=O)n1C)C

STL049030
Synonyms: 2,2'- [(3,4- dimethoxyphenyl)methanediyl]bis[5- (4- methoxyphenyl)cyclohexane- 1,3- dione]
Smiles: COc1cc(ccc1OC)C(C1C(=O)CC(CC1=O)c1ccc(cc1)OC)C1C(=O)CC(CC1=O)c1ccc(cc1)OC

STL049031
Synonyms: 1- (4- methylbenzyl)- 3- phenyl- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: Cc1ccc(cc1)Cn1cc([n+]2c1CCC2)c1ccccc1

STL049033
Synonyms: 4- hydroxy- N- [(2E)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CC(Cc1n[nH]/c(=N\C(=O)c2c(=O)[nH]c3c(c2O)cccc3)/s1)C

STL049039
Synonyms: N- (4- {[(3Z)- 3- {[(3,4- dimethylphenyl)sulfonyl]imino}- 3,4- dihydroquinoxalin- 2- yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(c(c1)C)C

STL049045
Synonyms: (5Z)- 5- {1- [(4- methylpiperazin- 4- ium- 1- yl)amino]ethylidene}- 2,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,2,5,6- tetrahydropyrimidin- 4- olate
Smiles: C=CCN1C(=O)N=C(/C(=C(/NN2CC[NH+](CC2)C)\C)/C1=O)[O-]

STL049052
Synonyms: methyl3- {[(E)- {1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene}methyl]amino}benzoate
Smiles: COC(=O)c1cccc(c1)N/C=C/1\C(=O)N=C(N(C1=O)CCC1=CCCCC1)S

STL049054
Synonyms: 3- (4- chlorophenyl)- 1- [2- (3,4- dichlorophenyl)- 2- oxoethyl]- 1,5,6,7- tetrahydropyrrolo[1,2- a]imidazol- 4- ium
Smiles: Clc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)c1ccc(c(c1)Cl)Cl

STL049057
Synonyms: (2E)- 3- [5- (3- chlorophenyl)furan- 2- yl]- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: Clc1cccc(c1)c1ccc(o1)/C=C(\C(=O)[O-])/Sc1[nH]nc([nH+]1)C

STL049058
Synonyms: 6- (2,5- dimethoxyphenyl)- 3- (5- phenyl- 1H- pyrazol- 3- yl)- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine
Smiles: COc1ccc(c(c1)C1=Nn2c(SC1)nnc2c1n[nH]c(c1)c1ccccc1)OC

STL049059
Synonyms: 3- [5- (furan- 2- yl)- 1,2,4- oxadiazol- 3- yl]quinolin- 2(1H)- one
Smiles: O=c1[nH]c2ccccc2cc1c1noc(n1)c1ccco1

STL049065
Synonyms: N'- [(E)- (2,4- dihydroxyphenyl)methylidene]- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccc(cc1O)O

STL049077
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STL049078
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (pyridin- 4- yl)pyrrolidin- 3- ylidene](4- propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)Cc1ccc[nH+]c1)/[O-]

STL049083
Synonyms: 3- chloro- 2- (piperidin- 1- ylmethyl)imidazo[1,2- a]pyridine
Smiles: Clc1c(CN2CCCCC2)nc2n1cccc2

STL049087
Synonyms: N- (4- methylphenyl)- N'- [(2Z)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]butanediamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)Nc2ccc(cc2)C)/s1)C

STL049095
Synonyms: (2Z)- 2- [(3- chlorophenyl)imino]- 5- nitro- N~6~- phenyl- 1,2- dihydropyrimidine- 4,6- diamine
Smiles: Clc1cccc(c1)/N=c/1\nc(N)c(c([nH]1)Nc1ccccc1)[N+](=O)[O-]

STL049097
Synonyms: 2- amino- 3- [(6- methoxy- 4- methylquinolin- 2- yl)sulfanyl]propanoate
Smiles: COc1ccc2c(c1)c(C)cc(n2)SCC(C(=O)[O-])N

STL049098
Synonyms: 5- [(4- methoxyphenoxy)methyl]furan- 3- carboxylate
Smiles: COc1ccc(cc1)OCc1occ(c1)C(=O)[O-]

STL049106
Synonyms: (5E)- 1- cycloheptyl- 2,6- dioxo- 5- [(piperidinium- 1- ylamino)methylidene]- 1,2,5,6- tetrahydropyrimidin- 4- olate
Smiles: [O-]C1=NC(=O)N(C(=O)/C/1=C/N[NH+]1CCCCC1)C1CCCCCC1

STL049117
Synonyms: 8- [(furan- 2- ylmethyl)amino]- 6- hydroxy- 3,7- dimethyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1n(C)c(n2)NCc1ccco1)C

STL049141
Synonyms: N- [(3Z)- 1- ethyl- 8- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pyridine- 4- carboxamide
Smiles: CCn1[nH]/c(=N\C(=O)c2ccncc2)/c2c1nc1c(C)cccc1c2

STL049146
Synonyms: N- [1- (3,5- dimethoxybenzyl)- 6,6- dimethyl- 2,4- dioxo- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]- 3- (4- methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)CCC(=O)NC1(C2=C(N(C1=O)Cc1cc(OC)cc(c1)OC)CC(CC2=O)(C)C)C(F)(F)F

STL049148
Synonyms: 1'- [(4- chlorophenyl)carbonyl]- 2'- [(4- fluorophenyl)carbonyl]- 7'- methyl- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Fc1ccc(cc1)C(=O)C1C(C(=O)c2ccc(cc2)Cl)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)C

STL049150
Synonyms: 4- bromo- 2- methoxy- 6- {(E)- [2- (morpholin- 4- ium- 4- yl)- 4- oxo- 1,3- thiazol- 5(4H)- ylidene]methyl}phenolate
Smiles: COc1cc(Br)cc(c1[O-])/C=C\1/SC(=NC1=O)[NH+]1CCOCC1

STL049165
Synonyms: N- {(E)- 3,4- dihydroisoquinolin- 2(1H)- yl[(4,6- dimethylpyrimidin- 2- yl)imino]methyl}- 2,2,2- trifluoroacetamide
Smiles: Cc1cc(C)nc(n1)/N=C(/N1CCc2c(C1)cccc2)\NC(=O)C(F)(F)F

STL049168
Synonyms: methylN- [(4- chlorobenzyl)carbamoyl]methioninate
Smiles: COC(=O)C(NC(=O)NCc1ccc(cc1)Cl)CCSC

STL049171
Synonyms: 1- [2- (3,4- dimethylphenyl)- 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)C)C

STL049172
Synonyms: 12- (4- methoxyphenyl)- 2- (3- methylphenyl)- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 3- ium- 9- olate
Smiles: COc1ccc(cc1)C1c2ccc(cc2Oc2c1c1nc([nH+]n1cn2)c1cccc(c1)C)[O-]

STL049180
Synonyms: 1- (3- methoxyphenyl)- 1',6'- dimethyl- 2,6- dioxo- 1,1',4',6- tetrahydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinolinium]- 4- olate
Smiles: COc1cccc(c1)N1C(=O)N=C(C2(C1=O)C[NH+](C)c1c(C2)cc(cc1)C)[O-]

STL049187
Synonyms: N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (propan- 2- yl)acetamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)C)C(C)C

STL049193
Synonyms: N- cyclooctyl- N'- [(2Z)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]butanediamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)NC2CCCCCCC2)/s1)C

STL049195
Synonyms: 2- [4- (3- methoxyphenoxy)quinazolin- 1- ium- 2- yl]phenolate
Smiles: COc1cccc(c1)Oc1nc([nH+]c2c1cccc2)c1ccccc1[O-]

STL049201
Synonyms: tert- butyl(2- {5- [(3- fluorobenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}ethyl)carbamate
Smiles: O=C(OC(C)(C)C)NCCc1nnc(o1)S(=O)(=O)Cc1cccc(c1)F

STL049203
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (pyridin- 3- yl)pyrrolidin- 3- ylidene][4- (2- methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)Cc1ccc[nH+]c1)/[O-])C

STL049208
Synonyms: 6- phenyl- 3- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: c1ccc(cc1)c1nn2c(s1)nnc2c1[nH]nc2c1CCC2

STL049209
Synonyms: 2- {4- [2- methyl- 5- (propan- 2- yl)phenoxy]quinazolin- 1- ium- 2- yl}phenolate
Smiles: CC(c1ccc(c(c1)Oc1nc([nH+]c2c1cccc2)c1ccccc1[O-])C)C

STL049211
Synonyms: (2Z)- 2- [(4- fluorophenyl)imino]- 7,7- dimethyl- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: Fc1ccc(cc1)/N=c/1\ncc2c([nH]1)CC(CC2=O)(C)C

STL049217
Synonyms: N- [(2Z)- 3- (cyclohexylamino)quinoxalin- 2(1H)- ylidene]- 4- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NC1CCCCC1

STL049218
Synonyms: 4- ethoxy- N- [(3E)- 6- methoxy- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzamide
Smiles: CCCn1[nH]/c(=N/C(=O)c2ccc(cc2)OCC)/c2c1nc1ccc(cc1c2)OC

STL049222
Synonyms: 4- {4- [(4- chlorophenyl)sulfonyl]piperazin- 1- yl}- N- [(2Z)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxobutanamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)c2ccc(cc2)Cl)/s1)C

STL049223
Synonyms: methylN- {[2- (4- chlorophenyl)ethyl]carbamoyl}leucinate
Smiles: COC(=O)C(NC(=O)NCCc1ccc(cc1)Cl)CC(C)C

STL049229
Synonyms: 8- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 1,3- dimethyl- 7- (4- nitrophenyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: [O-][N+](=O)c1ccc(cc1)c1cn2c(n1c1c(C)n(n(c1=O)c1ccccc1)C)nc1c2c(=O)n(c(=O)n1C)C

STL049232
Synonyms: ethyl[(5E)- 5- {[(4- nitrophenyl)carbonyl]imino}- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]acetate
Smiles: CCOC(=O)Cc1n[nH]/c(=N\C(=O)c2ccc(cc2)[N+](=O)[O-])/s1

STL049241
Synonyms: 5- [(1E)- N- (3- fluorophenyl)propanimidoyl]- 6- hydroxy- 1,3- dimethylpyrimidine- 2,4(1H,3H)- dione
Smiles: CC/C(=N\c1cccc(c1)F)/c1c(O)n(C)c(=O)n(c1=O)C

STL049250
Synonyms: (2Z)- 3- [5- (4- chlorophenyl)furan- 2- yl]- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: Clc1ccc(cc1)c1ccc(o1)/C=C(/C(=O)[O-])\Sc1[nH]nc([nH+]1)C

STL049254
Synonyms: (5E)- 6- hydroxy- 5- (1- {[2- (1H- indol- 3- yl)ethyl]amino}propylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C/1\C(=O)NC(=O)N=C1O)/NCCc1c[nH]c2c1cccc2

STL049265
Synonyms: methyl3- {[(1E)- 1- (6- hydroxy- 1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)propylidene]amino}benzoate
Smiles: CC/C(=N\c1cccc(c1)C(=O)OC)/c1c(O)n(C)c(=O)n(c1=O)C

STL049277
Synonyms: 2- [(4- amino- 5- cyclohexyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1N)C1CCCCC1

STL049284
Synonyms: 2- amino- 3- (1H- indol- 3- yl)- N'- [(E)- quinoxalin- 6- ylmethylidene]propanehydrazide(non- preferredname)
Smiles: O=C(C(Cc1c[nH]c2c1cccc2)N)N/N=C/c1ccc2c(c1)nccn2

STL049292
Synonyms: (5E)- 5- {1- [(4- ethoxyphenyl)amino]propylidene}- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: CCOc1ccc(cc1)N/C(=C/1\C(=NC(=NC1=O)O)O)/CC

STL049296
Synonyms: 3- {[(1E)- 1- (6- hydroxy- 1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)ethylidene]amino}benzoicacid
Smiles: OC(=O)c1cccc(c1)/N=C(/c1c(O)n(C)c(=O)n(c1=O)C)\C

STL049297
Synonyms: 3- {5- [(pyridinium- 2- ylmethyl)sulfanyl]- 1H- tetrazol- 1- yl}benzoate
Smiles: [O-]C(=O)c1cccc(c1)n1nnnc1SCc1cccc[nH+]1

STL049304
Synonyms: (2E)- 3- (9- ethyl- 9H- carbazol- 3- yl)- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: CCn1c2ccc(cc2c2c1cccc2)/C=C(\C(=O)[O-])/Sc1[nH]nc([nH+]1)C

STL049319
Synonyms: (2Z)- 2- [2- (2- methylquinolin- 4- yl)hydrazinylidene]butanedioicacid
Smiles: OC(=O)C/C(=N/Nc1cc(C)nc2c1cccc2)/C(=O)O

STL049344
Synonyms: 4- fluoro- N- [(2Z)- 3- [(3- methoxypropyl)amino]quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: COCCCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)F

STL049352
Synonyms: (5Z)- 5- [(1- acetyl- 1H- indol- 3- yl)methylidene]- 3- (2,4- dimethylphenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)N=C(/C(=C/c2cn(c3c2cccc3)C(=O)C)/C1=O)O

STL049364
Synonyms: 3- (2- bromophenoxy)- 8- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 2- methyl- 4- oxo- 4H- chromen- 7- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(C)c(c2=O)Oc1ccccc1Br

STL049365
Synonyms: N- [(2,3- dichlorophenyl)carbamoyl]isoleucine
Smiles: CCC(C(C(=O)O)NC(=O)Nc1cccc(c1Cl)Cl)C

STL049366
Synonyms: ethyl4- {[(1Z)- 1- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)ethyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N/C(=C\1/C(=NC(=NC1=O)O)O)/C

STL049373
Synonyms: 3- {[(E)- (2- hydroxy- 5- nitrophenyl)methylidene]amino}- 6,7- dimethoxy- 2- methylquinazolin- 4(3H)- one
Smiles: COc1cc2c(cc1OC)nc(n(c2=O)/N=C/c1cc(ccc1O)[N+](=O)[O-])C

STL049390
Synonyms: 5- {[(4- chlorophenyl)sulfanyl]methyl}[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Clc1ccc(cc1)SCc1cc(O)n2c(n1)ncn2

STL049399
Synonyms: N'- [(1E)- 1- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)ethyl]- 2- hydroxybenzohydrazide
Smiles: OC1=NC(=O)/C(=C(/NNC(=O)c2ccccc2O)\C)/C(=N1)O

STL049402
Synonyms: 6- hydroxy- 3- methyl- 8- (prop- 2- en- 1- ylamino)- 3,7- dihydro- 2H- purin- 2- one
Smiles: C=CCNc1[nH]c2c(n1)n(C)c(=O)nc2O

STL049425
Synonyms: methylN- [(4- sulfamoylbenzyl)carbamoyl]isoleucinate
Smiles: CCC(C(C(=O)OC)NC(=O)NCc1ccc(cc1)S(=O)(=O)N)C

STL049427
Synonyms: 3- [4- (6- methyl- 1,3- benzothiazol- 2- yl)phenyl]tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- imine5,5- dioxide
Smiles: Cc1ccc2c(c1)sc(n2)c1ccc(cc1)N1C(=N)SC2C1CS(=O)(=O)C2

STL049433
Synonyms: 4- {[(E)- (2- bromophenyl)methylidene]amino}- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Brc1ccccc1/C=N/n1c(S)nnc1c1n[nH]c(c1)c1ccccc1

STL049435
Synonyms: 4- hydroxy- 1- {1- [1- (2- methylphenyl)- 1H- tetrazol- 5- yl]cyclohexyl}pyrrolidinium- 2- carboxylate
Smiles: OC1C[NH+](C(C1)C(=O)[O-])C1(CCCCC1)c1nnnn1c1ccccc1C

STL049446
Synonyms: (5E)- 4,6- dioxo- 1- (prop- 2- en- 1- yl)- 5- [(1- propyl- 1,2,3,4- tetrahydroquinolinium- 6- yl)methylidene]- 1,4,5,6- tetrahydropyrimidine- 2- thiolate
Smiles: C=CCN1C(=NC(=O)/C(=C\c2ccc3c(c2)CCC[NH+]3CCC)/C1=O)[S-]

STL049449
Synonyms: (5E)- 1- butyl- 5- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCCCN1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)CC)/C1=O)S

STL049458
Synonyms: N- (3- ethoxypropyl)- 2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: CCOCCCNc1nc(CC)nc2c1oc1c2cccc1

STL049464
Synonyms: 2- ({(E)- [1- (4- chlorophenyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}amino)- 4- (methylsulfonyl)butanoicacid
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C\NC(C(=O)O)CCS(=O)(=O)C)/C1=O)S

STL049467
Synonyms: 2,2- dibromo- N- (hydrazinylcarbonothioyl)- 1- methylcyclopropanecarboxamide
Smiles: NNC(=S)NC(=O)C1(C)CC1(Br)Br

STL049471
Synonyms: ethyl[(5- {1- [(tert- butoxycarbonyl)amino]ethyl}- 1,3,4- oxadiazol- 2- yl)sulfonyl]acetate
Smiles: CCOC(=O)CS(=O)(=O)c1nnc(o1)C(NC(=O)OC(C)(C)C)C

STL049472
Synonyms: N'- [(Z)- {1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene}methyl]pentanehydrazide
Smiles: CCCCC(=O)NN/C=C\1/C(=NC(=O)N(C1=O)CCC1=CCCCC1)O

STL049475
Synonyms: 2- methyl- N- (5- oxo- 7- phenyl- 3,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)benzamide
Smiles: O=C1N=c2[nH]c(nn2C(C1)c1ccccc1)NC(=O)c1ccccc1C

STL049476
Synonyms: (2E)- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]- 3- (3,4,5- trimethoxyphenyl)prop- 2- enoate
Smiles: COc1cc(/C=C(\C(=O)[O-])/Sc2[nH]nc([nH+]2)C)cc(c1OC)OC

STL049490
Synonyms: methylN- [(2- methoxybenzyl)carbamoyl]leucinate
Smiles: COC(=O)C(NC(=O)NCc1ccccc1OC)CC(C)C

STL049509
Synonyms: (E)- {1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 2- [3- (3- methylbutoxy)phenyl]- 4,5- dioxopyrrolidin- 3- ylidene}(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methanolate
Smiles: CC(CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1)C

STL049511
Synonyms: 3- cyclohexyl- N- [1- (2,3- dimethoxybenzyl)- 6,6- dimethyl- 2,4- dioxo- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]propanamide
Smiles: COc1cccc(c1OC)CN1C2=C(C(C1=O)(NC(=O)CCC1CCCCC1)C(F)(F)F)C(=O)CC(C2)(C)C

STL049514
Synonyms: 2- {(E)- [(2- methyl- 1H- 3,1- benzimidazol- 3- ium- 1- yl)imino]methyl}- 4- nitrophenolate
Smiles: [O-]c1ccc(cc1/C=N/n1c(C)[nH+]c2c1cccc2)[N+](=O)[O-]

STL049518
Synonyms: N- [(3E)- 6- methoxy- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]tetrahydrofuran- 2- carboxamide
Smiles: COc1ccc2c(c1)cc1c(n2)n([nH]/c/1=N/C(=O)C1CCCO1)CC(C)C

STL049522
Synonyms: 1- imino- 3- phenyl[1,3]thiazolo[3,4- a]quinoxalin- 4- ol
Smiles: N=c1sc(c2n1c1ccccc1nc2O)c1ccccc1

STL049523
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 3- ylmethyl)- 2- (thiophen- 2- yl)pyrrolidin- 3- ylidene][4- (2- methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)Cc1ccc[nH+]c1)/[O-])C

STL049533
Synonyms: 2- [(4- methylphenoxy)methyl]- 12- phenyl- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 3- ium- 9- olate
Smiles: Cc1ccc(cc1)OCc1[nH+]n2c(n1)c1c(nc2)Oc2c(C1c1ccccc1)ccc(c2)[O-]

STL049548
Synonyms: (2E)- 3- (1,3- benzodioxol- 5- yl)- 2- [(3- methyl- 1H- 1,2,4- triazol- 4- ium- 5- yl)sulfanyl]prop- 2- enoate
Smiles: [O-]C(=O)/C(=C\c1ccc2c(c1)OCO2)/Sc1[nH]nc([nH+]1)C

STL049552
Synonyms: 2- {[5- (1- amino- 3- methylbutyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- 1- (4- chlorophenyl)ethanone
Smiles: CC(CC(c1nnc(o1)SCC(=O)c1ccc(cc1)Cl)N)C

STL049556
Synonyms: N,N,2- trimethyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: Cc1nc(N(C)C)c2c(n1)c1ccccc1o2

STL049561
Synonyms: 2- [({(6Z)- 4- amino- 6- [(4- methoxyphenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- yl}methyl)sulfanyl]ethanol
Smiles: OCCSCc1nc(N)n/c(=N\c2ccc(cc2)OC)/[nH]1

STL049569
Synonyms: 5- ethyl- 2- [(6- methoxy- 4- methylquinazolin- 2- yl)amino]- 6- methylpyrimidin- 4- ol
Smiles: COc1ccc2c(c1)c(C)nc(n2)Nc1nc(C)c(c(n1)O)CC

STL049578
Synonyms: methylN- (prop- 2- en- 1- ylcarbamoyl)- D- methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)NCC=C

STL049580
Synonyms: 6- methoxy- 3- [5- (4- methoxyphenyl)- 1,2,4- oxadiazol- 3- yl]quinolin- 2(1H)- one
Smiles: COc1ccc(cc1)c1onc(n1)c1cc2cc(OC)ccc2[nH]c1=O

STL049588
Synonyms: (5Z)- 5- {[5- (morpholin- 4- ium- 4- yl)furan- 2- yl]methylidene}- 4,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,4,5,6- tetrahydropyrimidine- 2- thiolate
Smiles: C=CCN1C(=NC(=O)/C(=C/c2ccc(o2)[NH+]2CCOCC2)/C1=O)[S-]

STL049595
Synonyms: 9a- [(E)- 2- (3- chlorophenyl)ethenyl]- 7,9,9- trimethyl- 9,9a- dihydro- 1H- imidazo[1,2- a]indol- 2(3H)- one
Smiles: O=C1CN2C(N1)(/C=C/c1cccc(c1)Cl)C(c1c2ccc(c1)C)(C)C

STL049597
Synonyms: 3- (3- nitrophenyl)- 1- (pyridin- 2- ylmethoxy)quinoxalin- 2(1H)- one4- oxide
Smiles: [O-][N+](=O)c1cccc(c1)c1c(=O)n(OCc2ccccn2)c2c([n+]1[O-])cccc2

STL049600
Synonyms: (5Z)- 5- {1- [(3- fluorophenyl)amino]ethylidene}- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C(\Nc2cccc(c2)F)/C)/C(=N1)O

STL049619
Synonyms: 2- (4- fluorophenoxy)- N- [(2E)- 5- (pyridin- 4- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: Fc1ccc(cc1)OCC(=O)/N=c/1\[nH]nc(s1)c1ccncc1

STL049625
Synonyms: N- [(3Z)- 1- butyl- 6- methoxy- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 2- methoxyacetamide
Smiles: CCCCn1[nH]/c(=N\C(=O)COC)/c2c1nc1ccc(cc1c2)OC

STL049626
Synonyms: 2- [(furan- 2- ylmethyl)amino]- 6- methyl- 5- (3- methylbutyl)pyrimidin- 4- ol
Smiles: CC(CCc1c(C)nc(nc1O)NCc1ccco1)C

STL049635
Synonyms: 3- ({(1E)- 1- [4- hydroxy- 1- (4- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}amino)benzoicacid
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/Nc1cccc(c1)C(=O)O

STL049637
Synonyms: (2E)- 2- [(4- methoxyphenyl)imino]- 5- nitro- 6- (piperidin- 1- yl)- 2,3- dihydropyrimidin- 4- amine
Smiles: COc1ccc(cc1)/N=c\1/nc(N2CCCCC2)c(c([nH]1)N)[N+](=O)[O-]

STL049640
Synonyms: (1S)- 1- {5- [(3- fluorobenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}- 2- phenylethanamine
Smiles: Fc1cccc(c1)CSc1nnc(o1)[C@H](Cc1ccccc1)N

STL049643
Synonyms: 8- [(furan- 2- ylmethyl)amino]- 6- hydroxy- 7- (2- hydroxyethyl)- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCn1c(NCc2ccco2)nc2c1c(O)nc(=O)n2C

STL049648
Synonyms: (3- {(Z)- [1- (4- methoxyphenyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 1H- indol- 1- yl)aceticacid
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cn(c3c2cccc3)CC(=O)O)/C1=O)S

STL049649
Synonyms: 5- amino- 1- [(3- nitrophenyl)carbonyl]- 1H- pyrazole- 3,4- dicarbonitrile
Smiles: N#Cc1nn(c(c1C#N)N)C(=O)c1cccc(c1)[N+](=O)[O-]

STL049654
Synonyms: ethylmethyl4,4'- (3- methyl- 6- oxo- 2,6- dihydropyrrolo[3,4- c]pyrazole- 4,5(4H)- diyl)dibenzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)c2c(C1c1ccc(cc1)C(=O)OC)c([nH]n2)C

STL049659
Synonyms: (3s,5s,7s)- N- [(2E)- 5- (2- ethoxyethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]tricyclo[3.3.1.1~3,7~]decane- 1- carboxamide
Smiles: CCOCCc1n[nH]/c(=N\C(=O)C23C[C@@H]4C[C@H](C3)C[C@H](C2)C4)/s1

STL049663
Synonyms: N- [(2Z)- 3- [(3- methoxypropyl)amino]quinoxalin- 2(1H)- ylidene]- 3- methylbenzenesulfonamide
Smiles: COCCCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)C

STL049671
Synonyms: 2- [4- (4- bromo- 2- methylphenoxy)quinazolin- 1- ium- 2- yl]phenolate
Smiles: Brc1ccc(c(c1)C)Oc1nc([nH+]c2c1cccc2)c1ccccc1[O-]

STL049672
Synonyms: (5E)- 1- (4- methylphenyl)- 2,6- dioxo- 5- (1- {[2- (piperidinium- 1- yl)ethyl]amino}propylidene)- 1,2,5,6- tetrahydropyrimidin- 4- olate
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)[O-])/NCC[NH+]1CCCCC1

STL049673
Synonyms: 2,6- di(furan- 2- yl)- 4- methyl- 3- propylpiperidin- 4- ol
Smiles: CCCC1C(NC(CC1(C)O)c1ccco1)c1ccco1

STL049692
Synonyms: (1S)- 2- (1H- indol- 3- yl)- 1- [5- (methylsulfanyl)- 1,3,4- oxadiazol- 2- yl]ethanamine
Smiles: CSc1nnc(o1)[C@H](Cc1c[nH]c2c1cccc2)N

STL049694
Synonyms: (2Z)- 2- [(4- fluorophenyl)imino]- 7- methyl- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: CC1CC(=O)c2c(C1)[nH]/c(=N/c1ccc(cc1)F)/nc2

STL049707
Synonyms: (1S)- 1- {5- [(2,5- dimethylbenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}- 2- (1H- indol- 3- yl)ethanamine
Smiles: Cc1ccc(c(c1)CSc1nnc(o1)[C@H](Cc1c[nH]c2c1cccc2)N)C

STL049708
Synonyms: 2- ethyl- N,N- dimethyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: CCc1nc(N(C)C)c2c(n1)c1ccccc1o2

STL049713
Synonyms: 2- [4- (2- ethoxyphenoxy)quinazolin- 1- ium- 2- yl]phenolate
Smiles: CCOc1ccccc1Oc1nc([nH+]c2c1cccc2)c1ccccc1[O-]

STL049714
Synonyms: N- [(3Z)- 1,8- dimethyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 2- fluorobenzamide
Smiles: Fc1ccccc1C(=O)/N=c/1\[nH]n(c2c1cc1cccc(c1n2)C)C

STL049723
Synonyms: N- [(3E)- 1- ethyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pyridine- 4- carboxamide
Smiles: CCn1[nH]/c(=N/C(=O)c2ccncc2)/c2c1nc1ccccc1c2

STL049746
Synonyms: ethyl4- {[(3Z)- 3- {[(4- methoxyphenyl)sulfonyl]imino}- 3,4- dihydroquinoxalin- 2- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)OC

STL049752
Synonyms: ethyl[(2E)- 5- (2- methoxyphenyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]carbamate
Smiles: CCOC(=O)/N=c/1\[nH]nc(s1)c1ccccc1OC

STL049754
Synonyms: 2- bromo- 6- methoxy- 4- [(E)- {2- [(4- nitro- 1H- pyrazol- 2- ium- 1- yl)acetyl]hydrazinylidene}methyl]phenolate
Smiles: COc1cc(/C=N/NC(=O)Cn2[nH+]cc(c2)[N+](=O)[O-])cc(c1[O-])Br

STL049765
Synonyms: 1- [(7- methyl- 1,2,3,4- tetrahydroquinolin- 2- yl)methyl]guanidine
Smiles: NC(=N)NCC1CCc2c(N1)cc(cc2)C

STL049776
Synonyms: 2- {[4- ethyl- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- fluoro- 4- methylphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1CC)SCC(=O)Nc1ccc(c(c1)F)C

STL049777
Synonyms: 3- {[(E)- (1- cycloheptyl- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)methyl]amino}benzoicacid
Smiles: O=C1N=C(O)/C(=C\Nc2cccc(c2)C(=O)O)/C(=O)N1C1CCCCCC1

STL049782
Synonyms: (5E)- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 2- hydroxy- 5- [(2- phenylhydrazinyl)methylidene]pyrimidine- 4,6(1H,5H)- dione
Smiles: OC1=NC(=O)/C(=C\NNc2ccccc2)/C(=O)N1CCC1=CCCCC1

STL049788
Synonyms: 3- chloro- N- [(4E)- 2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4(3H)- ylidene]aniline
Smiles: CCc1[nH]/c(=N/c2cccc(c2)Cl)/c2c(n1)c1ccccc1o2

STL049789
Synonyms: 3- [(3E)- 3- [(2E)- 1- hydroxy- 3- phenylprop- 2- en- 1- ylidene]- 2- (2- methoxyphenyl)- 4,5- dioxopyrrolidin- 1- yl]benzoicacid
Smiles: COc1ccccc1C1/C(=C(/C=C/c2ccccc2)\O)/C(=O)C(=O)N1c1cccc(c1)C(=O)O

STL049800
Synonyms: (2E)- 2- [(2E)- (4- bromobenzylidene)hydrazinylidene]- 3- hydroxy- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: Brc1ccc(cc1)/C=N/N=c/1\[nH]c2ccccc2c(=O)n1O

STL049801
Synonyms: [1- (2- methyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)piperidin- 4- yl](diphenyl)methanol
Smiles: Cc1nc(N2CCC(CC2)C(c2ccccc2)(c2ccccc2)O)c2c(n1)c1ccccc1o2

STL049802
Synonyms: 4- oxo- 4- [4- (2- phenylethyl)piperazin- 1- yl]- N- [(2Z)- 5- (trifluoromethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]butanamide
Smiles: O=C(N1CCN(CC1)CCc1ccccc1)CCC(=O)/N=c\1/[nH]nc(s1)C(F)(F)F

STL049804
Synonyms: {(5E)- 4- oxo- 5- [4- (piperidinium- 1- yl)benzylidene]- 2- thioxo- 1,3- thiazolidin- 3- yl}acetate
Smiles: [O-]C(=O)CN1C(=S)S/C(=C/c2ccc(cc2)[NH+]2CCCCC2)/C1=O

STL049806
Synonyms: (6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyltetrahydrofuran- 2- carboxylate
Smiles: O=C(C1CCCO1)OCc1cc2cc(C)ccc2[nH]c1=O

STL049825
Synonyms: 4- (4- methoxyphenyl)- N- [3- (morpholin- 4- yl)propyl]tetrahydro- 2H- pyran- 4- carboxamide
Smiles: COc1ccc(cc1)C1(CCOCC1)C(=O)NCCCN1CCOCC1