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

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STK837041
Synonyms: butyl4- ({4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}amino)benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK533692
Synonyms: 2- [(Z)- 1- nitro- 2- (propan- 2- ylamino)ethenyl]benzene- 1,4- diol
Smiles: CC(N/C=C(/c1cc(O)ccc1O)\[N+](=O)[O-])C

STK533693
Synonyms: propyl3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoate
Smiles: CCCOC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837044
Synonyms: N'- {4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}pyridine- 4- carbohydrazide
Smiles: O=C(NNC(=O)c1ccncc1)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837045
Synonyms: N- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 4- (morpholin- 4- ylsulfonyl)benzamide
Smiles: Clc1ccc(cc1)c1csc(n1)NC(=O)c1ccc(cc1)S(=O)(=O)N1CCOCC1

STK533700
Synonyms: 4- {(Z)- [4- oxo- 3- (phenylamino)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)Nc1ccccc1

STK837046
Synonyms: N- [(5Z)- 5- (2,6- dichlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 2- phenylacetamide
Smiles: O=C(NN1C(=S)S/C(=C\c2c(Cl)cccc2Cl)/C1=O)Cc1ccccc1

STK837047
Synonyms: N- (2- hydroxyethyl)- 4- [(5E)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- phenylbutanamide
Smiles: OCCN(c1ccccc1)C(=O)CCCN1C(=S)S/C(=C/c2cccs2)/C1=O

STK837048
Synonyms: N- (5- chloro- 2- hydroxyphenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1cc(Cl)ccc1O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK533715
Synonyms: 3,3'- [9H- fluorene- 9,9- diylbis(benzene- 4,1- diyloxy)]bis[1- (piperidin- 1- yl)propan- 2- ol]
Smiles: OC(CN1CCCCC1)COc1ccc(cc1)C1(c2ccc(cc2)OCC(CN2CCCCC2)O)c2ccccc2c2c1cccc2

STK533727
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- methylphenyl)butanamide
Smiles: O=C(Nc1ccccc1C)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837052
Synonyms: (5Z)- 5- (2,4- dichlorobenzylidene)- 3- (phenylamino)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Clc1ccc(c(c1)Cl)/C=C/1\SC(=S)N(C1=O)Nc1ccccc1

STK837054
Synonyms: 3- (1H- benzimidazol- 2- yl)- 6- ethyl- 7- hydroxy- 4H- chromen- 4- one
Smiles: CCc1cc2c(cc1O)occ(c2=O)c1nc2c([nH]1)cccc2

STK533729
Synonyms: ethyl4- (3- {[(4- methylphenyl)sulfonyl]amino}- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C1=C(NS(=O)(=O)c2ccc(cc2)C)C(=O)c2c(C1=O)cccc2

STK533731
Synonyms: N- (2- bromophenyl)- 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccccc1Br)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837055
Synonyms: 6- ethyl- 7- hydroxy- 3- (1- methyl- 1H- benzimidazol- 2- yl)- 4H- chromen- 4- one
Smiles: CCc1cc2c(cc1O)occ(c2=O)c1nc2c(n1C)cccc2

STK837057
Synonyms: 3- [(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (pyridin- 3- yl)propanamide
Smiles: O=C(Nc1cccnc1)CCN1C(=S)S/C(=C\c2ccccc2F)/C1=O

STK533738
Synonyms: {[5- (3- chloro- 1- benzothiophen- 2- yl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1nnc(n1c1ccccc1)c1sc2c(c1Cl)cccc2

STK533739
Synonyms: methyl(2E)- 2- [4- (acetyloxy)benzylidene]- 5- (4- chlorophenyl)- 7- methyl- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C\c1ccc(cc1)OC(=O)C)/s2

STK533741
Synonyms: (5Z)- 5- [(2E)- 3- (phenylamino)prop- 2- en- 1- ylidene]- 1- (prop- 2- en- 1- yl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: C=CCN1C(=O)NC(=O)/C(=C/C=C/Nc2ccccc2)/C1=O

STK837059
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (3- methoxyphenyl)butanamide
Smiles: COc1cccc(c1)NC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK533742
Synonyms: N- (5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- L- isoleucine
Smiles: CC[C@@H]([C@@H](C(=O)O)Nc1ncnc2c1c1CCCCc1s2)C

STK837061
Synonyms: 4- bromo- N- (6- bromo- 2- oxo- 4- phenyl- 1,2- dihydroquinolin- 3- yl)benzamide
Smiles: Brc1ccc(cc1)C(=O)Nc1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Br

STK837062
Synonyms: 4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [3- (trifluoromethyl)phenyl]butanamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837063
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (3,5- dichlorophenyl)butanamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK533747
Synonyms: (6- hydroxy- 3- nitro- 1- phenyl- 1H- indol- 2- yl)methylcarbamimidothioate
Smiles: NC(=N)SCc1c([N+](=O)[O-])c2c(n1c1ccccc1)cc(cc2)O

STK533749
Synonyms: N- [(Z)- (2,4- dichlorophenyl)methylidene]- N- [(2E)- 2- (hydroxyimino)cyclohexyl]amineoxide
Smiles: O/N=C/1\CCCCC1/[N+](=C/c1ccc(cc1Cl)Cl)/[O-]

STK837064
Synonyms: 2- [(5Z)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxy- 4- nitrophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1O)[N+](=O)[O-])CN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O

STK837066
Synonyms: N- (4- bromophenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(cc1)Br)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837067
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 7- [(2,6- dichlorobenzyl)oxy]- 2H- chromen- 2- one
Smiles: O=c1oc2cc(OCc3c(Cl)cccc3Cl)ccc2cc1c1nc2c(s1)cccc2

STK837068
Synonyms: N- (5- chloro- 2- hydroxyphenyl)- 3- [(5Z)- 5- (4- methoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: COc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)Nc1cc(Cl)ccc1O

STK533754
Synonyms: 2- [3- (2,3- diphenyl- 1H- benzo[g]indol- 1- yl)- 2- hydroxypropyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: OC(Cn1c(c2ccccc2)c(c2c1c1ccccc1cc2)c1ccccc1)CN1C(=O)c2c(C1=O)cccc2

STK837069
Synonyms: 4- [2- (furan- 2- yl)- 4- (phenylsulfonyl)- 1,3- oxazol- 5- yl]morpholine
Smiles: O=S(=O)(c1nc(oc1N1CCOCC1)c1ccco1)c1ccccc1

STK837071
Synonyms: N- cyclohexyl- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(NC1CCCCC1)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837072
Synonyms: ethyl4- {[(5Z)- 5- (3- methoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]acetyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)CN1C(=S)S/C(=C\c2cccc(c2)OC)/C1=O

STK533757
Synonyms: 3- nitro- N- (3- {[4- (9H- xanthen- 9- yl)phenyl]amino}quinoxalin- 2- yl)benzenesulfonamide
Smiles: [O-][N+](=O)c1cccc(c1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc(cc1)C1c2ccccc2Oc2c1cccc2

STK533759
Synonyms: 2- amino- 1- (3- chlorophenyl)- N- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Clc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1

STK533760
Synonyms: 6- methoxy- 2- [(pentafluorobenzyl)sulfanyl]pyrimidin- 4(3H)- one
Smiles: COc1cc(=O)[nH]c(n1)SCc1c(F)c(F)c(c(c1F)F)F

STK533761
Synonyms: 2- [(1- phenylethyl)sulfonyl]ethylcarbamimidothioate
Smiles: CC(S(=O)(=O)CCSC(=N)N)c1ccccc1

STK533764
Synonyms: methylN- {[3- (3,4- dichlorophenyl)- 4- {[(3,4- dichlorophenyl)carbamoyl](hydroxy)amino}- 5,5- dimethyl- 2- oxoimidazolidin- 1- yl]acetyl}glycinate
Smiles: COC(=O)CNC(=O)CN1C(=O)N(C(C1(C)C)N(C(=O)Nc1ccc(c(c1)Cl)Cl)O)c1ccc(c(c1)Cl)Cl

STK533765
Synonyms: 7'- methoxy- 2'- (3- methoxyphenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: COc1cccc(c1)C1=NN2C(C1)c1cccc(c1OC12CCN(CC1)C)OC

STK837077
Synonyms: N- cyclohexyl- 4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(NC1CCCCC1)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837079
Synonyms: propan- 2- yl2- methyl- 5- [(phenylcarbonyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccccc1)C

STK837082
Synonyms: 2,2- dimethyl- 4- (morpholin- 4- yl)tetrahydro- 2H- pyran- 4- carbonitrile
Smiles: N#CC1(CCOC(C1)(C)C)N1CCOCC1

STK837084
Synonyms: N- (2,4- dimethylphenyl)- 3- [(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc(cc1C)C)CCN1C(=S)S/C(=C\c2ccccc2F)/C1=O

STK837086
Synonyms: 6- ethyl- 7- hydroxy- 3- (1- methyl- 1H- benzimidazol- 2- yl)- 2- (propan- 2- yl)- 4H- chromen- 4- one
Smiles: CCc1cc2c(cc1O)oc(c(c2=O)c1nc2c(n1C)cccc2)C(C)C

STK533793
Synonyms: (5- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl)aceticacid
Smiles: OC(=O)CN1CC(=O)SC1=S

STK533794
Synonyms: 2- amino- N- (1,3- benzodioxol- 5- ylmethyl)- 1- (prop- 2- en- 1- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: C=CCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccc2c(c1)OCO2

STK533795
Synonyms: N'- {3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}pyridine- 4- carbohydrazide
Smiles: O=C(NNC(=O)c1ccncc1)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837091
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (naphthalen- 2- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)cccc2)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK533807
Synonyms: N'- {3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}- 4- fluorobenzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)F)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK533808
Synonyms: ethyl[(6- methoxy- 4- oxo- 1,2,3,4- tetrahydropyrimidin- 2- yl)sulfanyl]acetate
Smiles: CCOC(=O)CSC1NC(=O)C=C(N1)OC

STK533813
Synonyms: 2'- (3,4- dimethoxyphenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: COc1cc(ccc1OC)C1=NN2C(C1)c1ccccc1OC12CCN(CC1)C

STK837093
Synonyms: ethyl4- [(5Z)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CCOC(=O)CCCN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O

STK837096
Synonyms: N- benzyl- N- methyl- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N(Cc1ccccc1)C

STK837097
Synonyms: 5- (4- chlorophenyl)- 4- phenyl- 2- (2,4,5- trimethoxyphenyl)- 1H- imidazole
Smiles: COc1cc(OC)c(cc1c1[nH]c(c(n1)c1ccccc1)c1ccc(cc1)Cl)OC

STK837098
Synonyms: (5Z)- 5- (2- nitrobenzylidene)- 3- (phenylamino)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2ccccc2[N+](=O)[O-])/C(=O)N1Nc1ccccc1

STK533816
Synonyms: ethyl3- {(E)- [1- (4- fluorobenzyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/C=C/1\C(=O)NC(=O)N(C1=O)Cc1ccc(cc1)F)cccc2

STK533817
Synonyms: N- benzylpyrimido[4,5- b][1,4]benzoxazepin- 4- amine
Smiles: c1ccc(cc1)CNc1ncnc2c1N=Cc1c(O2)cccc1

STK533818
Synonyms: 5- [3'- (4- methylphenyl)- 1'- phenyl- 5- (thiophen- 2- yl)- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl]- 5- oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1cn(nc1c1ccc(cc1)C)c1ccccc1)c1cccs1

STK837099
Synonyms: N- (2- methoxyphenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: COc1ccccc1NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK533820
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (naphthalen- 1- yl)butanamide
Smiles: O=C(Nc1cccc2c1cccc2)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837100
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (5- chloro- 2- hydroxyphenyl)butanamide
Smiles: O=C(Nc1cc(Cl)ccc1O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837102
Synonyms: (5E)- 3- [4- oxo- 4- (pyrrolidin- 1- yl)butyl]- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C/c2cccs2)/C(=O)N1CCCC(=O)N1CCCC1

STK837103
Synonyms: ethyl4- (quinolin- 8- ylsulfonyl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)S(=O)(=O)c1cccc2c1nccc2

STK837104
Synonyms: N- (2- hydroxyethyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- phenylpropanamide
Smiles: OCCN(c1ccccc1)C(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837105
Synonyms: 2- (4- chlorophenyl)- 2- oxoethyl1- (quinolin- 8- ylsulfonyl)piperidine- 4- carboxylate
Smiles: Clc1ccc(cc1)C(=O)COC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nccc2

STK533833
Synonyms: N- {4- [(2- methoxy- 5- {(Z)- [2,4,6- trioxo- 1- (prop- 2- en- 1- yl)tetrahydropyrimidin- 5(2H)- ylidene]methyl}benzyl)oxy]phenyl}acetamide
Smiles: C=CCN1C(=O)NC(=O)/C(=C/c2ccc(c(c2)COc2ccc(cc2)NC(=O)C)OC)/C1=O

STK837107
Synonyms: (5Z)- 5- (3- bromobenzylidene)- 3- [4- oxo- 4- (pyrrolidin- 1- yl)butyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Brc1cccc(c1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N1CCCC1

STK533836
Synonyms: 2- [(5- butyl- 4- hydroxy- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: CCCCc1c(O)nc([nH]c1=O)SCC(=O)Nc1ccc(cc1)C

STK837109
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,3- dichlorophenyl)butanamide
Smiles: O=C(Nc1cccc(c1Cl)Cl)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837110
Synonyms: 4- (4- methoxyphenyl)- 2- oxo- 1,3- benzoxathiol- 5- yl(4- bromophenoxy)acetate
Smiles: COc1ccc(cc1)c1c(ccc2c1sc(=O)o2)OC(=O)COc1ccc(cc1)Br

STK837111
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- ethylphenyl)butanamide
Smiles: CCc1ccccc1NC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837113
Synonyms: ethyl{[3- (1,3- benzothiazol- 2- yl)- 6- ethyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetate
Smiles: CCOC(=O)COc1cc2occ(c(=O)c2cc1CC)c1nc2c(s1)cccc2

STK533849
Synonyms: N'- {3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}pyridine- 3- carbohydrazide
Smiles: O=C(NNC(=O)c1cccnc1)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK533850
Synonyms: 4- [(Z)- {4- oxo- 3- [(phenylacetyl)amino]- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]benzoicacid
Smiles: O=C(NN1C(=S)S/C(=C\c2ccc(cc2)C(=O)O)/C1=O)Cc1ccccc1

STK837114
Synonyms: N- benzyl- N- tert- butyl- 3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(N(C(C)(C)C)Cc1ccccc1)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK533855
Synonyms: 2- amino- N- (1,3- benzodioxol- 5- ylmethyl)- 1- phenyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: O=C(c1c2nc3ccccc3nc2n(c1N)c1ccccc1)NCc1ccc2c(c1)OCO2

STK533856
Synonyms: 2- ({4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}amino)benzoicacid
Smiles: O=C(Nc1ccccc1C(=O)O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837116
Synonyms: 3,3'- (2- thioxoimidazolidine- 1,3- diyl)dipropanenitrile
Smiles: N#CCCN1CCN(C1=S)CCC#N

STK533858
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 2- methoxypropanoicacid
Smiles: COC(C(=O)O)Cc1nc2c(s1)cccc2

STK837117
Synonyms: 2- methoxyethyl5- [(2- chloro- 6- fluorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCc1c(F)cccc1Cl)cc2

STK533866
Synonyms: N- (2- hydroxy- 5- nitrophenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1cc(ccc1O)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837118
Synonyms: 2- (6- chloro- 2- methyl- 4- phenylquinazolin- 3(4H)- yl)acetohydrazide
Smiles: NNC(=O)CN1C(=Nc2c(C1c1ccccc1)cc(cc2)Cl)C

STK533867
Synonyms: 6- bromo- 2,3- dihydro- 1H- cyclopenta[b]quinoxaline4,9- dioxide
Smiles: Brc1ccc2c(c1)[n+]([O-])c1c([n+]2[O-])CCC1

STK837119
Synonyms: N- (3- bromophenyl)- 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1cccc(c1)Br)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK533875
Synonyms: 1- (1',3',5- triphenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl)ethanone
Smiles: CC(=O)N1N=C(CC1c1cn(nc1c1ccccc1)c1ccccc1)c1ccccc1

STK837120
Synonyms: N- benzyl- 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxyethyl)butanamide
Smiles: OCCN(C(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O)Cc1ccccc1

STK533877
Synonyms: N- (2- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- L- methionine
Smiles: CSCC[C@@H](C(=O)O)Nc1nc(C)nc2c1c1CCCCc1s2

STK533879
Synonyms: N- [4- ({2- methoxy- 5- [(Z)- (2,4,6- trioxo- 1- phenyltetrahydropyrimidin- 5(2H)- ylidene)methyl]benzyl}oxy)phenyl]acetamide
Smiles: COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1

STK533881
Synonyms: 1,2- diethoxy- 4,5- dinitrobenzene
Smiles: CCOc1cc([N+](=O)[O-])c(cc1OCC)[N+](=O)[O-]

STK837122
Synonyms: N- benzyl- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- phenylpropanamide
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)N(c1ccccc1)Cc1ccccc1

STK533882
Synonyms: 4- [(6- bromo- 4- phenylquinazolin- 2- yl)amino]benzoicacid
Smiles: Brc1ccc2c(c1)c(nc(n2)Nc1ccc(cc1)C(=O)O)c1ccccc1

STK533890
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 6- ethyl- 7- methoxy- 4H- chromen- 4- one
Smiles: CCc1cc2c(cc1OC)occ(c2=O)c1nc2c(s1)cccc2

STK533894
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxy- 5- nitrophenyl)butanamide
Smiles: O=C(Nc1cc(ccc1O)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837125
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- ethoxyphenyl)butanamide
Smiles: CCOc1ccc(cc1)NC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837128
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- chlorophenyl)butanamide
Smiles: O=C(Nc1ccc(cc1)Cl)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837130
Synonyms: 5- (diphenylmethyl)- 6- hydroxy- 2- (propylsulfanyl)pyrimidin- 4(1H)- one
Smiles: CCCSc1[nH]c(O)c(c(=O)n1)C(c1ccccc1)c1ccccc1

STK837133
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- methoxyphenyl)butanamide
Smiles: COc1ccccc1NC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK533903
Synonyms: pentyl4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CCCCCOC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837134
Synonyms: ethyl5- [(1- methoxy- 1- oxopropan- 2- yl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(cc2)OC(C(=O)OC)C

STK837135
Synonyms: 2- tert- butyl- 6- ethyl- 3- (1- methyl- 1H- benzimidazol- 2- yl)- 4- oxo- 4H- chromen- 7- yl2,2- dimethylpropanoate
Smiles: CCc1cc2c(cc1OC(=O)C(C)(C)C)oc(c(c2=O)c1nc2c(n1C)cccc2)C(C)(C)C

STK533908
Synonyms: N- (5,6- dimethylthieno[2,3- d]pyrimidin- 4- yl)- L- isoleucine
Smiles: CC[C@@H]([C@@H](C(=O)O)Nc1ncnc2c1c(C)c(s2)C)C

STK533911
Synonyms: 1- {[(5- methylpyridin- 2- yl)amino]methyl}- 1H- indole- 2,3- dione
Smiles: Cc1ccc(nc1)NCN1c2ccccc2C(=O)C1=O

STK533916
Synonyms: 2- (4- chlorophenyl)- 2- oxoethyl(2E)- 3- (thiophen- 2- yl)prop- 2- enoate
Smiles: O=C(OCC(=O)c1ccc(cc1)Cl)/C=C/c1cccs1

STK837136
Synonyms: methyl4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: COC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK533918
Synonyms: 2- amino- 1- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carbonitrile
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCCO2

STK837137
Synonyms: 2- (4- methoxyphenyl)- 1- (2- methylpropyl)- 1H- benzimidazole
Smiles: COc1ccc(cc1)c1nc2c(n1CC(C)C)cccc2

STK837138
Synonyms: 5- phenyl- 5H- pyrano[2,3- d:6,5- d']dipyrimidine- 4,6- diol
Smiles: Oc1ncnc2c1C(c1ccccc1)c1c(O2)ncnc1O

STK533923
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- methylpiperazin- 1- yl)propanamide
Smiles: CN1CCN(CC1)NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK533930
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (naphthalen- 1- yl)propanamide
Smiles: O=C(Nc1cccc2c1cccc2)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK533931
Synonyms: methyl4- [3- (1H- benzotriazol- 1- yl)- 2- hydroxypropoxy]benzoate
Smiles: COC(=O)c1ccc(cc1)OCC(Cn1nnc2c1cccc2)O

STK837143
Synonyms: propan- 2- yl2- methyl- 5- [(pentafluorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(OCc1c(F)c(F)c(c(c1F)F)F)cc2)C

STK837145
Synonyms: 2- methyl- 3- (1- methyl- 1H- benzimidazol- 2- yl)- 7- [(4- nitrobenzyl)oxy]- 4H- chromen- 4- one
Smiles: [O-][N+](=O)c1ccc(cc1)COc1ccc2c(c1)oc(c(c2=O)c1nc2c(n1C)cccc2)C

STK837146
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- ethyl- N- (2- hydroxyethyl)propanamide
Smiles: OCCN(C(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O)CC

STK837147
Synonyms: 1- phenyl- 4- {[(E)- 2- phenylethenyl]sulfonyl}piperazine
Smiles: O=S(=O)(N1CCN(CC1)c1ccccc1)/C=C/c1ccccc1

STK837148
Synonyms: 3- [(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)propanamide
Smiles: O=C(NC12CC3CC(C2)CC(C1)C3)CCN1C(=S)S/C(=C\c2ccccc2F)/C1=O

STK533944
Synonyms: 2- {[(2- amino- 5- methylphenyl)(phenyl)methyl]amino}acetohydrazide(non- preferredname)
Smiles: NNC(=O)CNC(c1cc(C)ccc1N)c1ccccc1

STK533946
Synonyms: 2- amino- 1- cyclohexyl- N- (furan- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)C1CCCCC1)NCc1ccco1

STK837149
Synonyms: 3- [(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [3- (morpholin- 4- yl)propyl]propanamide
Smiles: O=C(CCN1C(=S)S/C(=C\c2ccccc2F)/C1=O)NCCCN1CCOCC1

STK533947
Synonyms: 1- methyl- 2'- (5- methylfuran- 2- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc(o1)C

STK533948
Synonyms: ethyl5- hydroxy- 2- methyl- 8- (4- nitrophenyl)- 6- phenyl- 1,6- dihydropyrrolo[2,3- e]indazole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)[nH]c2c1cc(O)c1c2c(nn1c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK533949
Synonyms: N- (2,4- dichlorophenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837150
Synonyms: (3Z)- 3- {(2E)- 2- [(3- methoxyphenyl)imino]- 4- oxo- 1,3- thiazolidin- 5- ylidene}- 1,3- dihydro- 2H- indol- 2- one
Smiles: COc1cccc(c1)/N=C/1\NC(=O)/C(=C\2/C(=O)Nc3c2cccc3)/S1

STK837151
Synonyms: ethyl5- [(1- ethoxy- 1- oxopropan- 2- yl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(C(=O)OCC)C)c1ccccc1

STK533951
Synonyms: 2- [(5Z)- 5- (3,4- dimethoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoicacid
Smiles: COc1cc(ccc1OC)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C

STK837154
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- nitrophenyl)propanamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837155
Synonyms: N- {3- [(2- chlorophenyl)amino]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Clc1ccccc1Nc1nc2ccccc2nc1NS(=O)(=O)c1ccccc1

STK533954
Synonyms: 2- (dimethylamino)ethyl4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CN(CCOC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O)C

STK533955
Synonyms: 5- (1,3- dimethyl- 2,4- dioxo- 1,3,4,5- tetrahydro- 2H- chromeno[2,3- d]pyrimidin- 5- yl)- 1,3- dimethylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CN1C(=O)N(C)C(=O)C(C1=O)C1c2ccccc2Oc2c1c(=O)n(C)c(=O)n2C

STK533956
Synonyms: (2E)- 3- {3- [(furan- 2- ylmethyl)sulfamoyl]- 4- methoxyphenyl}prop- 2- enoicacid
Smiles: COc1ccc(cc1S(=O)(=O)NCc1ccco1)/C=C/C(=O)O

STK837156
Synonyms: 2- oxo- 2- phenylethyl(2E)- 3- (thiophen- 2- yl)prop- 2- enoate
Smiles: O=C(/C=C/c1cccs1)OCC(=O)c1ccccc1

STK533961
Synonyms: (3Z)- 1- acetyl- 3- [3- (2- fluorophenyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: CC(=O)N1C(=O)/C(=C/2\SC(=S)N(C2=O)c2ccccc2F)/c2c1cccc2

STK533963
Synonyms: 3- (1H- benzimidazol- 2- yl)- 8- [(2- ethylpiperidin- 1- yl)methyl]- 7- hydroxy- 2H- chromen- 2- one
Smiles: CCC1CCCCN1Cc1c(O)ccc2c1oc(=O)c(c2)c1nc2c([nH]1)cccc2

STK533970
Synonyms: 2- (4- benzylpiperazin- 1- yl)- 1- (4- nitrophenyl)ethanol
Smiles: OC(c1ccc(cc1)[N+](=O)[O-])CN1CCN(CC1)Cc1ccccc1

STK533974
Synonyms: 8- amino- 3- cyclohexyl- 7- methylbenzo[g]pteridine- 2,4(1H,3H)- dione
Smiles: Nc1cc2nc3[nH]c(=O)n(c(=O)c3nc2cc1C)C1CCCCC1

STK837159
Synonyms: (5Z)- 3- [3- (azepan- 1- yl)- 3- oxopropyl]- 5- (2- chlorobenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2ccccc2Cl)/C(=O)N1CCC(=O)N1CCCCCC1

STK837160
Synonyms: 1- {[(E)- 2- phenylethenyl]sulfonyl}- 4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazine
Smiles: O=S(=O)(N1CCN(CC1)C/C=C/c1ccccc1)/C=C/c1ccccc1

STK533977
Synonyms: 2- [(3- {(5E)- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}propanoyl)amino]benzoicacid
Smiles: C/C(=C\c1ccccc1)/C=C\1/SC(=S)N(C1=O)CCC(=O)Nc1ccccc1C(=O)O

STK837161
Synonyms: 2- (benzylamino)- 4- (phenylamino)pyridine- 3- carbonitrile
Smiles: N#Cc1c(ccnc1NCc1ccccc1)Nc1ccccc1

STK533978
Synonyms: N'- {4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}- 2- nitrobenzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837162
Synonyms: N'- [(E)- (5- bromo- 2- hydroxyphenyl)methylidene]- 9- hydroxy- 9H- fluorene- 9- carbohydrazide
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)C1(O)c2ccccc2c2c1cccc2)O

STK837163
Synonyms: N- cyclohexyl- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(NC1CCCCC1)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK533983
Synonyms: 6- (3,5- dichloro- 2- hydroxybenzyl)- 7- hydroxy- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidin- 5- one
Smiles: Clc1cc(Cc2c(O)nc3n(c2=O)CCS3)c(c(c1)Cl)O

STK837164
Synonyms: N- (4- hydroxyphenyl)- 3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc(cc1)O)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837165
Synonyms: ethyl5- {[(3,4- dimethoxyphenyl)carbonyl]oxy}- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccc(c(c1)OC)OC)c1ccccc1

STK533985
Synonyms: 2,7- bis(2- methoxyphenyl)- 5,10- di(thiophen- 2- yl)tetrahydropyrrolo[3,4- c]pyrrolo[3',4':4,5]pyrazolo[1,2- a]pyrazole- 1,3,6,8(2H,3aH,5H,7H)- tetrone
Smiles: COc1ccccc1N1C(=O)C2C(C1=O)N1N(C2c2cccs2)C2C(C1c1cccs1)C(=O)N(C2=O)c1ccccc1OC

STK837166
Synonyms: 2- ({5- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [2- (morpholin- 4- yl)ethyl]acetamide
Smiles: C=CCn1c(SCC(=O)NCCN2CCOCC2)nnc1CSc1nc2c(s1)cccc2

STK837167
Synonyms: ethyl2- amino- 1- (3,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)OC)OC

STK837169
Synonyms: 4- [(5Z)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- ethyl- N- (2- hydroxyethyl)butanamide
Smiles: OCCN(C(=O)CCCN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O)CC

STK837170
Synonyms: N- (4- methoxyphenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: COc1ccc(cc1)NC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837171
Synonyms: (2E)- 3- [4- methoxy- 3- (piperidin- 1- ylsulfonyl)phenyl]- 1- [2- (prop- 2- en- 1- ylsulfanyl)- 1H- benzimidazol- 1- yl]prop- 2- en- 1- one
Smiles: C=CCSc1nc2c(n1C(=O)/C=C/c1ccc(c(c1)S(=O)(=O)N1CCCCC1)OC)cccc2

STK533994
Synonyms: 4- {3- (6- chloro- 2- hydroxy- 4- phenylquinolin- 3- yl)- 5- [4- (dimethylamino)phenyl]- 4,5- dihydro- 1H- pyrazol- 1- yl}- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)N(C)C)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK533996
Synonyms: (3Z)- 3- [4- oxo- 2- {[3- (trifluoromethyl)phenyl]amino}- 1,3- thiazol- 5(4H)- ylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1N=C(S/C/1=C/1\C(=O)Nc2c1cccc2)Nc1cccc(c1)C(F)(F)F

STK533997
Synonyms: (5Z)- 1- butyl- 5- [(2E)- 3- (phenylamino)prop- 2- en- 1- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCCCN1C(=O)NC(=O)/C(=C/C=C/Nc2ccccc2)/C1=O

STK534000
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (morpholin- 4- yl)propanamide
Smiles: O=C(NN1CCOCC1)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837175
Synonyms: 4- nitrophenyl(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)acetate
Smiles: O=C(CN1C(=O)c2c(C1=O)cccc2)Oc1ccc(cc1)[N+](=O)[O-]

STK837177
Synonyms: 3- bromo- N- butyl- 5- phenyl- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CCCCNC(=O)c1nn2c(c1Br)nc(cc2C(F)(F)F)c1ccccc1

STK534002
Synonyms: 4- (4- bromophenyl)- 2- oxo- 1,3- benzoxathiol- 5- yl(2- fluorophenoxy)acetate
Smiles: O=C(Oc1ccc2c(c1c1ccc(cc1)Br)sc(=O)o2)COc1ccccc1F

STK837179
Synonyms: ethyl4- {3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837180
Synonyms: N- cyclopentyl- 3- [(5Z)- 5- (3,4- dimethoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: COc1cc(ccc1OC)/C=C/1\SC(=S)N(C1=O)CCC(=O)NC1CCCC1

STK534005
Synonyms: ethylN- [{5- bromo- 2- [(chloroacetyl)amino]phenyl}(phenyl)methyl]glycinate
Smiles: CCOC(=O)CNC(c1cc(Br)ccc1NC(=O)CCl)c1ccccc1

STK837183
Synonyms: N'- [(2Z)- 2- hydroxy- 4- oxo- 4- phenylbut- 2- enoyl]benzohydrazide
Smiles: O/C(=C\C(=O)c1ccccc1)/C(=O)NNC(=O)c1ccccc1

STK837185
Synonyms: 2- methoxyethyl5- {[(4- bromophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccc(cc1)Br

STK534015
Synonyms: N'- {3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}pyridine- 4- carbohydrazide
Smiles: O=C(NNC(=O)c1ccncc1)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837188
Synonyms: (3Z)- 3- [3- (2- fluorophenyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: Fc1ccccc1N1C(=S)S/C(=C/2\C(=O)Nc3c2cccc3)/C1=O

STK534017
Synonyms: methylN- [{2- [(4- {[(benzyloxy)carbonyl]amino}butanoyl)amino]- 5- bromophenyl}(phenyl)methyl]glycinate
Smiles: COC(=O)CNC(c1cc(Br)ccc1NC(=O)CCCNC(=O)OCc1ccccc1)c1ccccc1

STK837189
Synonyms: ethyl2- {[(2E)- 3- phenylprop- 2- enoyl]amino}- 1- (prop- 2- en- 1- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCn1c2nc3ccccc3nc2c(c1NC(=O)/C=C/c1ccccc1)C(=O)OCC

STK534019
Synonyms: bis[3- (piperidin- 1- yl)propyl]trans- 2,4- diphenylcyclobutane- 1,3- dicarboxylate
Smiles: O=C([C@@H]1[C@H](c2ccccc2)[C@H]([C@H]1c1ccccc1)C(=O)OCCCN1CCCCC1)OCCCN1CCCCC1

STK837190
Synonyms: 1- benzyl- 4- {[(E)- 2- phenylethenyl]sulfonyl}piperazine
Smiles: O=S(=O)(N1CCN(CC1)Cc1ccccc1)/C=C/c1ccccc1

STK837191
Synonyms: 3- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (pyridin- 2- yl)propanamide
Smiles: O=C(Nc1ccccn1)CCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK534022
Synonyms: 2'- (2- methoxyphenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: COc1ccccc1C1=NN2C(C1)c1ccccc1OC12CCN(CC1)C

STK534024
Synonyms: 1',3',5- triphenyl- 2- (phenylsulfonyl)- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazole
Smiles: O=S(=O)(N1N=C(CC1c1cn(nc1c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1

STK534025
Synonyms: 2- amino- N- (prop- 2- en- 1- yl)- 1- (3- sulfamoylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)S(=O)(=O)N

STK534027
Synonyms: N'- {4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}- 2- methoxybenzohydrazide
Smiles: COc1ccccc1C(=O)NNC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837196
Synonyms: 3- [(5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- cyanoethyl)- N- phenylpropanamide
Smiles: N#CCCN(c1ccccc1)C(=O)CCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

STK534031
Synonyms: 1- ({5- [(E)- 2- carboxyethenyl]- 2,3- dimethoxyphenyl}sulfonyl)piperidine- 4- carboxylicacid
Smiles: COc1cc(/C=C/C(=O)O)cc(c1OC)S(=O)(=O)N1CCC(CC1)C(=O)O

STK534033
Synonyms: 4- ({1- [3- (dimethylamino)propyl]- 4- hydroxy- 2- (4- methylphenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrol- 3- yl}carbonyl)- N,N- dimethylbenzenesulfonamide
Smiles: CN(CCCN1C(=O)C(=C(C1c1ccc(cc1)C)C(=O)c1ccc(cc1)S(=O)(=O)N(C)C)O)C

STK534034
Synonyms: 3- [(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (3- methoxyphenyl)propanamide
Smiles: COc1cccc(c1)NC(=O)CCN1C(=S)S/C(=C\c2ccccc2F)/C1=O

STK837203
Synonyms: 3- [(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- methoxyphenyl)propanamide
Smiles: COc1ccccc1NC(=O)CCN1C(=S)S/C(=C\c2ccccc2F)/C1=O

STK534038
Synonyms: 6- (2- {[(E)- (4- methoxyphenyl)methylidene]amino}phenoxy)- 1,3- dimethylpyrimidine- 2,4(1H,3H)- dione
Smiles: COc1ccc(cc1)/C=N/c1ccccc1Oc1cc(=O)n(c(=O)n1C)C

STK837204
Synonyms: 2- hydroxy- N'- {4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837205
Synonyms: (5Z)- 5- (2- chlorobenzylidene)- 3- [3- (4- methylpiperidin- 1- yl)- 3- oxopropyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CC1CCN(CC1)C(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837207
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (1,3- thiazol- 2- yl)butanamide
Smiles: O=C(Nc1nccs1)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534040
Synonyms: N,N'- diethyl- 6- [(2E)- 2- (3,4,5- trimethoxybenzylidene)hydrazinyl]- 1,3,5- triazine- 2,4- diamine
Smiles: CCNc1nc(N/N=C/c2cc(OC)c(c(c2)OC)OC)nc(n1)NCC

STK534042
Synonyms: N- (5,6- dimethylthieno[2,3- d]pyrimidin- 4- yl)- L- alanine
Smiles: OC(=O)[C@@H](Nc1ncnc2c1c(C)c(s2)C)C

STK534046
Synonyms: 6,6'- (pyridin- 4- ylmethanediyl)bis(7- hydroxy- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidin- 5- one)
Smiles: Oc1nc2SCCn2c(=O)c1[C@H](c1c(O)nc2n(c1=O)CCS2)c1ccncc1

STK534051
Synonyms: 2- amino- 1- (4- butoxyphenyl)- N- cyclohexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)NC1CCCCC1

STK837208
Synonyms: (2E)- 2- cyano- 3- (4- fluorophenyl)but- 2- enehydrazide
Smiles: NNC(=O)/C(=C(/c1ccc(cc1)F)\C)/C#N

STK534058
Synonyms: (3Z)- 5- bromo- 3- {2- [(4- bromophenyl)amino]- 4- oxo- 1,3- thiazol- 5(4H)- ylidene}- 1,3- dihydro- 2H- indol- 2- one
Smiles: Brc1ccc(cc1)NC1=NC(=O)/C(=C\2/C(=O)Nc3c2cc(Br)cc3)/S1

STK837210
Synonyms: ethyl4- (3- {(5Z)- 5- [4- (methoxycarbonyl)benzylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}propanoyl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C(=O)OC)/C1=O

STK534063
Synonyms: ethyl4- ({3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837213
Synonyms: 3- [(5Z)- 5- (4- methoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,4,6- trimethylphenyl)propanamide
Smiles: COc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)Nc1c(C)cc(cc1C)C

STK837215
Synonyms: pentyl4- [(5E)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CCCCCOC(=O)CCCN1C(=S)S/C(=C/c2cccs2)/C1=O

STK534068
Synonyms: 2- amino- N- (1,3- benzodioxol- 5- ylmethyl)- 1- (pyridin- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccn1)NCc1ccc2c(c1)OCO2

STK534069
Synonyms: N- (5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- L- valine
Smiles: CC([C@@H](C(=O)O)Nc1ncnc2c1c1CCCCc1s2)C

STK534070
Synonyms: 4- hydroxy- N'- {3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837216
Synonyms: 7- methyl- 4- nitro- 2,1,3- benzoxadiazole1- oxide
Smiles: [O-][N+](=O)c1ccc(c2c1no[n+]2[O-])C

STK837217
Synonyms: diethyl3- methyl- 5- ({[4- (morpholin- 4- ylsulfonyl)phenyl]carbonyl}amino)thiophene- 2,4- dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)S(=O)(=O)N2CCOCC2)sc(c1C)C(=O)OCC

STK534071
Synonyms: (2E)- 2- cyano- 3- [2- (morpholin- 4- yl)quinolin- 3- yl]prop- 2- enamide
Smiles: N#C/C(=C\c1cc2ccccc2nc1N1CCOCC1)/C(=O)N

STK837220
Synonyms: 1- (9H- carbazol- 9- yl)- 3- (4- methoxyphenoxy)propan- 2- ol
Smiles: COc1ccc(cc1)OCC(Cn1c2ccccc2c2c1cccc2)O

STK534072
Synonyms: 5- [(4- fluorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylicacid
Smiles: Fc1ccc(cc1)COc1ccc2c(c1)c(C(=O)O)c(o2)C

STK837221
Synonyms: N- (2- chlorophenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccccc1Cl)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837224
Synonyms: N- (2- methoxyphenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: COc1ccccc1NC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534078
Synonyms: 1- (diphenylphosphoryl)cyclobutanecarboxylicacid
Smiles: OC(=O)C1(CCC1)P(=O)(c1ccccc1)c1ccccc1

STK534079
Synonyms: (4Z)- 5- (4- methoxyphenyl)- 2- phenyl- 4- {2- [3- (trifluoromethyl)phenyl]hydrazinylidene}- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)C1=NN(C(=O)/C/1=N\Nc1cccc(c1)C(F)(F)F)c1ccccc1

STK837225
Synonyms: N- (2- ethylphenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: CCc1ccccc1NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837227
Synonyms: 8- [(4- benzylpiperazin- 1- yl)sulfonyl]quinoline
Smiles: O=S(=O)(c1cccc2c1nccc2)N1CCN(CC1)Cc1ccccc1

STK837228
Synonyms: (2E)- 3- phenylprop- 2- en- 1- yl3- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)propanoate
Smiles: O=C(CCn1c(=O)c2cccc3c2c(c1=O)ccc3)OC/C=C/c1ccccc1

STK534084
Synonyms: 5- benzyl- 6- hydroxy- 3- (2- methoxyphenyl)- 2- [(2- oxo- 2- phenylethyl)sulfanyl]pyrimidin- 4(3H)- one
Smiles: COc1ccccc1n1c(SCC(=O)c2ccccc2)nc(c(c1=O)Cc1ccccc1)O

STK534085
Synonyms: ethyl4- {3- [1- cyano- 2- oxo- 2- (pentylamino)ethyl]quinoxalin- 2- yl}piperazine- 1- carboxylate
Smiles: CCCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(=O)OCC)C#N

STK534087
Synonyms: N'- (6- bromo- 4- phenylquinazolin- 2- yl)- 2- (morpholin- 4- yl)acetohydrazide
Smiles: O=C(CN1CCOCC1)NNc1nc2ccc(cc2c(n1)c1ccccc1)Br

STK534092
Synonyms: 8- (azepan- 1- ylmethyl)- 3- (1,3- benzothiazol- 2- yl)- 7- hydroxy- 2H- chromen- 2- one
Smiles: O=c1oc2c(cc1c1nc3c(s1)cccc3)ccc(c2CN1CCCCCC1)O

STK534094
Synonyms: 2- benzyl- 4- [(dimethylamino)methyl]- 1- benzofuran- 5- ol
Smiles: CN(Cc1c(O)ccc2c1cc(o2)Cc1ccccc1)C

STK837229
Synonyms: 1- hydroxy- 4- methoxy- 1,4- dihydroquinoxaline- 2,3- dione
Smiles: COn1c2ccccc2n(c(=O)c1=O)O

STK534100
Synonyms: N- (4- acetylphenyl)- 4- [(5E)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CCCN1C(=S)S/C(=C/c2cccs2)/C1=O

STK837232
Synonyms: 1- (4- nitrophenyl)- 2- (4- phenylpiperazin- 1- yl)ethanol
Smiles: OC(c1ccc(cc1)[N+](=O)[O-])CN1CCN(CC1)c1ccccc1

STK534103
Synonyms: N'- {3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}- 3- nitrobenzohydrazide
Smiles: O=C(NNC(=O)c1cccc(c1)[N+](=O)[O-])CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837233
Synonyms: N- (1,3- benzodioxol- 5- yl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534107
Synonyms: 2- [(5- butyl- 4- hydroxy- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]- N- (4- methoxyphenyl)acetamide
Smiles: CCCCc1c(O)nc([nH]c1=O)SCC(=O)Nc1ccc(cc1)OC

STK837236
Synonyms: ethyl4- ({4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837237
Synonyms: 2- [2- (4- phenyl- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 3- yl)ethyl]- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: S=c1[nH]nc(n1c1ccccc1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK837242
Synonyms: N- [3- (morpholin- 4- yl)propyl]- 2- {[4- phenyl- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(CSc1nnc(n1c1ccccc1)c1cccnc1)NCCCN1CCOCC1

STK534114
Synonyms: 2- amino- 1- (4- bromophenyl)- N- cyclohexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Brc1ccc(cc1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NC1CCCCC1

STK534117
Synonyms: N- (2- benzyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- L- alanine
Smiles: OC(=O)[C@@H](Nc1nc(Cc2ccccc2)nc2c1c1CCCCc1s2)C

STK534118
Synonyms: 2- [(5Z)- 5- (4- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoicacid
Smiles: CC(N1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O)C(=O)O

STK837243
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 2- oxo- 2H- chromen- 7- yl4- methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1ccc2c(c1)oc(=O)c(c2)c1nc2c(s1)cccc2

STK837244
Synonyms: butyl4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CCCCOC(=O)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837245
Synonyms: N- (4- acetylphenyl)- 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534125
Synonyms: 4- chloro- N- {3- [(1- oxo- 1,3- dihydro- 2- benzofuran- 5- yl)amino]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc2c(c1)COC2=O

STK534129
Synonyms: 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)- N'- [(E)- (2- methoxyphenyl)methylidene]propanehydrazide
Smiles: COc1ccccc1/C=N/NC(=O)CCn1nc(cc1C)C

STK837250
Synonyms: (2E)- 1- [2- (prop- 2- yn- 1- ylsulfanyl)- 1H- benzimidazol- 1- yl]- 3- (thiophen- 2- yl)prop- 2- en- 1- one
Smiles: C#CCSc1nc2c(n1C(=O)/C=C/c1cccs1)cccc2

STK534134
Synonyms: 2- (2,4- dichlorophenyl)- 4- ethyl- 5,5- dimethyl- 2,5- dihydro- 1H- imidazol- 1- ol3- oxide
Smiles: CCC1=[N+]([O-])C(N(C1(C)C)O)c1ccc(cc1Cl)Cl

STK837252
Synonyms: 4- (morpholin- 4- ylsulfonyl)- N- (4- phenyl- 1,3- thiazol- 2- yl)benzamide
Smiles: O=C(c1ccc(cc1)S(=O)(=O)N1CCOCC1)Nc1scc(n1)c1ccccc1

STK837253
Synonyms: ethyl{[3- (1,3- benzothiazol- 2- yl)- 2- oxo- 2H- chromen- 7- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)oc(=O)c(c2)c1nc2c(s1)cccc2

STK837254
Synonyms: 1- (9H- carbazol- 9- yl)- 3- (4- methylphenoxy)propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)COc1ccc(cc1)C

STK837257
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- nitrophenyl)propanamide
Smiles: O=C(Nc1ccccc1[N+](=O)[O-])CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837259
Synonyms: N- (4- methyl- 1,3- thiazol- 2- yl)- 4- [(5E)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1scc(n1)C)CCCN1C(=S)S/C(=C/c2cccs2)/C1=O

STK837261
Synonyms: 2- [4- oxo- 4- (4- phenylpiperazin- 1- yl)butyl]- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=C(N1CCN(CC1)c1ccccc1)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK534146
Synonyms: N,1',3'- triphenyl- 5- (thiophen- 2- yl)- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazole- 2- carbothioamide
Smiles: S=C(N1N=C(CC1c1cn(nc1c1ccccc1)c1ccccc1)c1cccs1)Nc1ccccc1

STK837262
Synonyms: methyl3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoate
Smiles: COC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837263
Synonyms: 2- [4- bromo- 5- methyl- 3- (trifluoromethyl)- 1H- pyrazol- 1- yl]- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)Cn1nc(c(c1C)Br)C(F)(F)F

STK837264
Synonyms: ethyl5- {[(4- chlorophenyl)carbonyl]oxy}- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccc(cc1)Cl)c1ccccc1

STK837266
Synonyms: N- (6- bromo- 2- oxo- 4- phenyl- 1,2- dihydroquinolin- 3- yl)- 4- chlorobenzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Br

STK534153
Synonyms: 1,2- dinitro- 4,5- dipropoxybenzene
Smiles: CCCOc1cc([N+](=O)[O-])c(cc1OCCC)[N+](=O)[O-]

STK837267
Synonyms: 2- (2,3- dihydro- 1H- indol- 1- yl)- 1- (4- nitrophenyl)ethanol
Smiles: OC(c1ccc(cc1)[N+](=O)[O-])CN1CCc2c1cccc2

STK534157
Synonyms: (4E)- 4- [2- (pyridin- 4- ylcarbonyl)hydrazinylidene]- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxylicacid
Smiles: O=C(c1ccncc1)N/N=C/1\CCCc2c1cc(o2)C(=O)O

STK837269
Synonyms: N- [3- (9H- carbazol- 9- yl)- 2- hydroxypropyl]- N- phenylmethanesulfonamide
Smiles: OC(CN(S(=O)(=O)C)c1ccccc1)Cn1c2ccccc2c2c1cccc2

STK837272
Synonyms: N- [4- (morpholin- 4- yl)phenyl]naphthalene- 2- sulfonamide
Smiles: O=S(=O)(c1ccc2c(c1)cccc2)Nc1ccc(cc1)N1CCOCC1

STK534164
Synonyms: 2- (2,4- dichlorophenyl)- 4,5,5- trimethyl- 2,5- dihydro- 1H- imidazol- 1- ol3- oxide
Smiles: Clc1ccc(c(c1)Cl)C1[N+](=C(C(N1O)(C)C)C)[O-]

STK534167
Synonyms: 1,2- dinitro- 4,5- bis(propan- 2- yloxy)benzene
Smiles: CC(Oc1cc([N+](=O)[O-])c(cc1OC(C)C)[N+](=O)[O-])C

STK534168
Synonyms: 4- ({4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}amino)benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534169
Synonyms: N- [3- (1,3- benzodioxol- 5- ylamino)quinoxalin- 2- yl]- 4- bromobenzenesulfonamide
Smiles: Brc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc2c(c1)OCO2

STK837273
Synonyms: N- (2- bromophenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccccc1Br)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534171
Synonyms: 2- bromo- N- [(2Z)- 4- (4- chlorophenyl)- 3- (4- methylphenyl)- 1,3- thiazol- 2(3H)- ylidene]benzamide
Smiles: Cc1ccc(cc1)n1/c(=N/C(=O)c2ccccc2Br)/scc1c1ccc(cc1)Cl

STK837274
Synonyms: N- (3,4- dichlorophenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837275
Synonyms: propan- 2- yl5- [2- (benzyloxy)- 2- oxoethoxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: O=C(OCc1ccccc1)COc1ccc2c(c1)c(C(=O)OC(C)C)c(o2)C

STK837277
Synonyms: 3- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,4- dichlorophenyl)propanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK837278
Synonyms: 2- hydroxy- N'- {4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1O)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STL036486
Synonyms: (4- aminophenyl)(5- methoxy- 1- benzofuran- 3- yl)methanone
Smiles: COc1ccc2c(c1)c(co2)C(=O)c1ccc(cc1)N

STK534178
Synonyms: N'- {4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}- 3- nitrobenzohydrazide
Smiles: O=C(NNC(=O)c1cccc(c1)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837279
Synonyms: propan- 2- yl5- {[(4- bromophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccc(cc1)Br)C

STK837281
Synonyms: 2- (3,4- dimethoxyphenyl)- 1- (morpholin- 4- yl)ethanethione
Smiles: COc1cc(ccc1OC)CC(=S)N1CCOCC1

STK837282
Synonyms: N- [(5Z)- 5- (4- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 2- phenylacetamide
Smiles: O=C(NN1C(=S)S/C(=C\c2ccc(cc2)Br)/C1=O)Cc1ccccc1

STK837283
Synonyms: N- (3- chloro- 4- fluorophenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837284
Synonyms: 1- [(pyridin- 2- ylamino)methyl]- 1H- indole- 2,3- dione
Smiles: O=C1C(=O)c2c(N1CNc1ccccn1)cccc2

STK837285
Synonyms: ethyl2- methyl- 5- [(thiophen- 2- ylcarbonyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1cccs1

STK534182
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,4,6- trimethylphenyl)propanamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837286
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (pyridin- 2- yl)butanamide
Smiles: O=C(Nc1ccccn1)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534185
Synonyms: (4Z)- 4- {[6- ethoxy- 2- (phenylsulfanyl)quinolin- 3- yl]methylidene}- 2- phenyl- 1,3- oxazol- 5(4H)- one
Smiles: CCOc1ccc2c(c1)cc(c(n2)Sc1ccccc1)/C=C/1\N=C(OC1=O)c1ccccc1

STK534188
Synonyms: N- (5,6- dimethylthieno[2,3- d]pyrimidin- 4- yl)- L- phenylalanine
Smiles: OC(=O)[C@@H](Nc1ncnc2c1c(C)c(s2)C)Cc1ccccc1

STK837292
Synonyms: methyl5- {[(4- bromophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccc(cc1)Br

STK837294
Synonyms: N- (biphenyl- 4- yl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(cc1)c1ccccc1)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837296
Synonyms: 1- (9H- carbazol- 9- yl)- 3- (2,4,6- trimethylphenoxy)propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)COc1c(C)cc(cc1C)C

STK837297
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,3- dichlorophenyl)propanamide
Smiles: O=C(Nc1cccc(c1Cl)Cl)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837298
Synonyms: N- (2- hydroxy- 4- nitrophenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc(cc1O)[N+](=O)[O-])CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837299
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- phenylethyl)butanamide
Smiles: O=C(CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O)NCCc1ccccc1

STK837301
Synonyms: (3Z)- 3- {[(2- phenylethyl)amino]methylidene}- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Nc2c(/C/1=C/NCCc1ccccc1)cccc2

STK837303
Synonyms: 2- {[4- hydroxy- 6- oxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2)nc(cc1=O)O

STK534199
Synonyms: 3- {(5E)- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}propanoicacid
Smiles: C/C(=C\c1ccccc1)/C=C\1/SC(=S)N(C1=O)CCC(=O)O

STK534201
Synonyms: N- (4- bromo- 2- {[(2- hydrazinyl- 2- oxoethyl)amino](phenyl)methyl}phenyl)- 3,4,5- trimethoxybenzamide(non- preferredname)
Smiles: NNC(=O)CNC(c1cc(Br)ccc1NC(=O)c1cc(OC)c(c(c1)OC)OC)c1ccccc1

STK837305
Synonyms: ethyl5- [(2- chlorobenzyl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccccc1Cl)cc2)c1ccccc1

STK534206
Synonyms: 2'- (4- bromophenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc(cc1)Br

STK837307
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (3- methylphenyl)butanamide
Smiles: O=C(Nc1cccc(c1)C)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837308
Synonyms: 2- (3- nitrophenyl)- 2,3- dihydro- 4H- [1,3]thiazino[3,2- a]benzimidazol- 4- one
Smiles: [O-][N+](=O)c1cccc(c1)C1CC(=O)n2c(S1)nc1c2cccc1

STK837309
Synonyms: {[3- (1,3- benzothiazol- 2- yl)- 2- oxo- 2H- chromen- 7- yl]oxy}acetonitrile
Smiles: N#CCOc1ccc2c(c1)oc(=O)c(c2)c1nc2c(s1)cccc2

STK534209
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,4,6- trimethylphenyl)propanamide
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)Nc1c(C)cc(cc1C)C

STK837311
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (morpholin- 4- yl)butanamide
Smiles: O=C(NN1CCOCC1)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534211
Synonyms: 2- methoxy- 4- (1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazin]- 2'- yl)phenol
Smiles: COc1cc(ccc1O)C1=NN2C(C1)c1ccccc1OC12CCN(CC1)C

STK837312
Synonyms: 8- methyl- 7- (4- methylphenyl)- 6- phenyl- 7H- purine
Smiles: Cc1ccc(cc1)n1c(C)nc2c1c(ncn2)c1ccccc1

STK534216
Synonyms: N'- {3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}pyridine- 3- carbohydrazide
Smiles: O=C(NNC(=O)c1cccnc1)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK534219
Synonyms: N- [4- chloro- 2- (phenylcarbonyl)phenyl]- 2- (piperidin- 1- yl)acetamide
Smiles: O=C(Nc1ccc(cc1C(=O)c1ccccc1)Cl)CN1CCCCC1

STK837313
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [3- (trifluoromethyl)phenyl]propanamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534221
Synonyms: 4- ({3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)O)C(=O)O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534222
Synonyms: 5,6- bis(4- methoxyphenyl)- 3- (methylsulfanyl)- 1,2,4- triazine
Smiles: COc1ccc(cc1)c1nc(SC)nnc1c1ccc(cc1)OC

STK534223
Synonyms: N- benzyl- 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- phenylpropanamide
Smiles: O=C(N(c1ccccc1)Cc1ccccc1)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534225
Synonyms: N- (4- chloro- 2- {[(2- hydrazinyl- 2- oxoethyl)amino](phenyl)methyl}phenyl)- 4- methoxybenzamide(non- preferredname)
Smiles: NNC(=O)CNC(c1cc(Cl)ccc1NC(=O)c1ccc(cc1)OC)c1ccccc1

STK534229
Synonyms: N- (6- ethylthieno[2,3- d]pyrimidin- 4- yl)- L- methionine
Smiles: CSCC[C@@H](C(=O)O)Nc1ncnc2c1cc(s2)CC

STK534231
Synonyms: 2- cyano- 2- [3- (2,6- dimethylmorpholin- 4- yl)quinoxalin- 2- yl]- N- (prop- 2- en- 1- yl)acetamide
Smiles: C=CCNC(=O)C(c1nc2ccccc2nc1N1CC(C)OC(C1)C)C#N

STK837314
Synonyms: 2- {(5Z)- 4- oxo- 5- [4- (propan- 2- yl)benzylidene]- 2- thioxo- 1,3- thiazolidin- 3- yl}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccc(cc2)C(C)C)/C1=O)Nc1nccs1

STK837315
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- methylphenyl)propanamide
Smiles: O=C(Nc1ccccc1C)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837316
Synonyms: 2- [(5Z)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- methyl- 1,3- thiazol- 2- yl)acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O)Nc1scc(n1)C

STK837317
Synonyms: 2- [(5Z)- 5- (4- ethoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- methyl- 1,3- thiazol- 2- yl)acetamide
Smiles: CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CC(=O)Nc1scc(n1)C

STK534234
Synonyms: 2- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N'- [(4- methylphenyl)sulfonyl]acetohydrazide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O)NNS(=O)(=O)c1ccc(cc1)C

STK534239
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- {[bis(2- methylpropyl)amino]methyl}- 7- hydroxy- 2H- chromen- 2- one
Smiles: CC(CN(Cc1c(O)ccc2c1oc(=O)c(c2)c1nc2c(s1)cccc2)CC(C)C)C

STK837319
Synonyms: 2- (2,4- dimethoxyphenyl)- 4,5- bis(4- fluorophenyl)- 1H- imidazole
Smiles: COc1ccc(c(c1)OC)c1[nH]c(c(n1)c1ccc(cc1)F)c1ccc(cc1)F

STK534241
Synonyms: 9'- bromo- 2'- (2- methoxyphenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: COc1ccccc1C1=NN2C(C1)c1cc(Br)ccc1OC12CCN(CC1)C

STK837321
Synonyms: 2- [(5Z)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (5- chloro- 2- hydroxyphenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1O)CN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O

STK837323
Synonyms: 6- bromo- 3',3'- dimethyl- 1'- phenyl- 1',3'- dihydrospiro[chromene- 2,2'- indole]
Smiles: Brc1ccc2c(c1)C=CC1(O2)N(c2ccccc2)c2c(C1(C)C)cccc2

STK837324
Synonyms: 2- ({1- [(4- methoxyphenyl)sulfonyl]piperidin- 4- yl}methyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3

STK837329
Synonyms: (1E)- 1- hydrazinylidene- 6- nitro- 2,3,4,9- tetrahydro- 1H- carbazole
Smiles: N/N=C/1\CCCc2c1[nH]c1c2cc(cc1)[N+](=O)[O-]

STK837330
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 7- hydroxy- 4H- chromen- 4- one
Smiles: Oc1ccc2c(c1)occ(c2=O)c1nc2c(s1)cccc2

STK534247
Synonyms: 1- (diphenylphosphoryl)cyclopentanecarboxylicacid
Smiles: OC(=O)C1(CCCC1)P(=O)(c1ccccc1)c1ccccc1

STK837332
Synonyms: (5Z)- 3- (3,4- dimethylphenyl)- 5- [(2E)- 3- (2- nitrophenyl)prop- 2- en- 1- ylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\C=C\c2ccccc2[N+](=O)[O-])/C(=O)N1c1ccc(c(c1)C)C

STK837333
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,4- dichlorophenyl)butanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534251
Synonyms: 1- {[(E)- 2- phenylethenyl]sulfonyl}piperidine- 4- carboxylicacid
Smiles: OC(=O)C1CCN(CC1)S(=O)(=O)/C=C/c1ccccc1

STK837335
Synonyms: methyl4- [(Z)- (3- {3- [(5- methyl- 1,3,4- thiadiazol- 2- yl)amino]- 3- oxopropyl}- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)Nc1nnc(s1)C

STK837336
Synonyms: (5E)- 5- (2- fluorobenzylidene)- 2- [(4- fluorophenyl)amino]- 1,3- thiazol- 4(5H)- one
Smiles: Fc1ccc(cc1)NC1=NC(=O)/C(=C\c2ccccc2F)/S1

STK534262
Synonyms: ethyl3,3,3- trifluoro- 2- hydroxy- 2- {4- [(3- {[(3- nitrophenyl)sulfonyl]amino}quinoxalin- 2- yl)amino]phenyl}propanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)Nc1nc2ccccc2nc1NS(=O)(=O)c1cccc(c1)[N+](=O)[O-])O

STK534263
Synonyms: 3- amino- 7- methoxyquinoxaline- 2- carbonitrile1,4- dioxide
Smiles: COc1ccc2c(c1)[n+]([O-])c(c([n+]2[O-])N)C#N

STK837338
Synonyms: N- tert- butyl- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(NC(C)(C)C)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837339
Synonyms: ethyl4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CCOC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534270
Synonyms: 1- (9H- carbazol- 9- yl)- 3- (2,4- dichlorophenoxy)propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)COc1ccc(cc1Cl)Cl

STK534271
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- phenylbutanamide
Smiles: O=C(Nc1ccccc1)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534272
Synonyms: 2'- (4- bromophenyl)- 7'- methoxy- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: COc1cccc2c1OC1(CCN(CC1)C)N1C2CC(=N1)c1ccc(cc1)Br

STK534273
Synonyms: methyl2- methyl- 5- {[4- (2- phenyl- 1,3- oxazol- 5- yl)benzyl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(OCc1ccc(cc1)c1cnc(o1)c1ccccc1)cc2

STK534275
Synonyms: (5Z)- 5- (4- methylbenzylidene)- 3- [3- (4- methylpiperidin- 1- yl)- 3- oxopropyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CC1CCN(CC1)C(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534277
Synonyms: N- (2- benzyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- L- methionine
Smiles: CSCC[C@@H](C(=O)O)Nc1nc(Cc2ccccc2)nc2c1c1CCCCc1s2

STK534278
Synonyms: 4- (4- methoxyphenyl)- 2- oxo- 1,3- benzoxathiol- 5- yl(2,4- dichlorophenoxy)acetate
Smiles: COc1ccc(cc1)c1c(ccc2c1sc(=O)o2)OC(=O)COc1ccc(cc1Cl)Cl

STK534283
Synonyms: 5- {1- [(2- hydroxyethyl)amino]ethylidene}- 1,3- dimethylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: OCCNC(=C1C(=O)N(C)C(=O)N(C1=O)C)C

STK837342
Synonyms: ethyl5- [(4- chlorobenzyl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccc(cc1)Cl)cc2)c1ccccc1

STK837343
Synonyms: 3,3,3- trifluoro- 2- methyl- N- (3- nitrophenyl)- 2- (trifluoromethyl)propanamide
Smiles: O=C(C(C(F)(F)F)(C(F)(F)F)C)Nc1cccc(c1)[N+](=O)[O-]

STK534289
Synonyms: (6- bromo- 2- methoxynaphthalen- 1- yl)aceticacid
Smiles: COc1ccc2c(c1CC(=O)O)ccc(c2)Br

STK534291
Synonyms: 2- [(Z)- {[(3E)- 3- (hydroxyimino)butan- 2- yl](oxido)- lambda~5~- azanylidene}methyl]- 4,5- dimethyl- 1H- imidazol- 1- ol
Smiles: O/N=C(/C(/[N+](=C/c1nc(c(n1O)C)C)/[O-])C)\C

STK534293
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (naphthalen- 1- yl)butanamide
Smiles: O=C(Nc1cccc2c1cccc2)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837345
Synonyms: ethyl5- {[(4- chlorophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccc(cc1)Cl

STK837346
Synonyms: methyl[6- chloro- 2- (4- methoxyphenyl)- 4- phenylquinazolin- 3(4H)- yl]acetate
Smiles: COC(=O)CN1C(=Nc2c(C1c1ccccc1)cc(cc2)Cl)c1ccc(cc1)OC

STK837347
Synonyms: (5Z)- 3- [3- (4- benzylpiperidin- 1- yl)- 3- oxopropyl]- 5- (2- chlorobenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: O=C(N1CCC(CC1)Cc1ccccc1)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534299
Synonyms: 2'- (4- chlorophenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc(cc1)Cl

STK534300
Synonyms: (2E)- N- (2,3- dimethylphenyl)- 2- (3- hydroxybenzylidene)hydrazinecarbothioamide
Smiles: Oc1cccc(c1)/C=N/NC(=S)Nc1cccc(c1C)C

STK534301
Synonyms: 4- [3,5- bis(4- methoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)OC)C(=O)CCC(=O)O

STK534305
Synonyms: 1- methyl- 2'- (thiophen- 2- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1cccs1

STK837349
Synonyms: (5Z)- 5- (2- chlorobenzylidene)- 3- [4- oxo- 4- (4- phenylpiperazin- 1- yl)butyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: O=C(N1CCN(CC1)c1ccccc1)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534310
Synonyms: 4- [5- (2- chloro- 6- methylquinolin- 3- yl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cc2cc(C)ccc2nc1Cl)c1ccccc1

STK837351
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (5- chloro- 2- hydroxyphenyl)propanamide
Smiles: O=C(Nc1cc(Cl)ccc1O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534314
Synonyms: (5Z)- 5- [(5- methylthiophen- 2- yl)methylidene]- 1- [3- (trifluoromethyl)phenyl]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(s1)/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)C(F)(F)F

STK534316
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,4- dimethylphenyl)butanamide
Smiles: O=C(Nc1ccc(cc1C)C)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534321
Synonyms: (2E)- 3- {3- [(3- hydroxypropyl)sulfamoyl]- 4- methoxyphenyl}prop- 2- enoicacid
Smiles: OCCCNS(=O)(=O)c1cc(/C=C/C(=O)O)ccc1OC

STK534325
Synonyms: (9E)- 9- (4- fluorobenzylidene)- 5- (4- fluorophenyl)- 3- phenyl- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Fc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccccc1)/C(=C/c1ccc(cc1)F)/CCC2

STK534327
Synonyms: methyl4- [(4- {2- [(4R,7S)- 1,3- dioxo- 1,3,3a,4,7,7a- hexahydro- 2H- 4,7- methanoisoindol- 2- yl]ethyl}piperazin- 1- yl)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)CN1CCN(CC1)CCN1C(=O)C2C(C1=O)[C@@H]1C[C@H]2C=C1

STK534329
Synonyms: 4- [5- (3,4- dimethoxyphenyl)- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1cc(ccc1OC)C1CC(=NN1C(=O)CCC(=O)O)c1cccs1

STK837359
Synonyms: N- (4- hydroxyphenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(cc1)O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837360
Synonyms: 2- bromo- N- (6- bromo- 2- oxo- 4- phenyl- 1,2- dihydroquinolin- 3- yl)benzamide
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(=O)[nH]2)NC(=O)c1ccccc1Br

STK534334
Synonyms: (2Z)- 4- (2,6- dimethylphenyl)- 2- hydroxy- 4- oxobut- 2- enoicacid
Smiles: O=C(c1c(C)cccc1C)/C=C(/C(=O)O)\O

STK534339
Synonyms: 2'- [4- (difluoromethoxy)phenyl]- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc(cc1)OC(F)F

STK534341
Synonyms: 2- (dimethylamino)ethyl4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CN(CCOC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O)C

STK534342
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 7- hydroxy- 8- [(2- methylpiperidin- 1- yl)methyl]- 2H- chromen- 2- one
Smiles: CC1CCCCN1Cc1c(O)ccc2c1oc(=O)c(c2)c1nc2c(s1)cccc2

STK837363
Synonyms: (3E)- 1- benzyl- 3- (4H- 1,2,4- triazol- 4- ylimino)- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1/C(=N/n2cnnc2)/c2c(N1Cc1ccccc1)cccc2

STK837364
Synonyms: 2- (4- fluorophenyl)- 2- oxoethyl1- (naphthalen- 2- ylsulfonyl)piperidine- 4- carboxylate
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cccc2)OCC(=O)c1ccc(cc1)F

STK534347
Synonyms: 3- ({4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}amino)benzoicacid
Smiles: O=C(Nc1cccc(c1)C(=O)O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837365
Synonyms: N- benzyl- N- tert- butyl- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N(C(C)(C)C)Cc1ccccc1

STK837367
Synonyms: N- {(5Z)- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}- 2- phenylacetamide
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)NC(=O)Cc1ccccc1

STK534349
Synonyms: N- (4- bromophenyl)- 2- {[5- ethyl- 4- hydroxy- 6- oxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 2- yl]sulfanyl}acetamide
Smiles: CCc1c(O)nc(n(c1=O)CC=C)SCC(=O)Nc1ccc(cc1)Br

STK837369
Synonyms: N- (biphenyl- 4- yl)- 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc(cc1)c1ccccc1)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534350
Synonyms: 2- [3- (4- benzylpiperazin- 1- yl)quinoxalin- 2- yl]- 2- cyano- N- hexylacetamide
Smiles: CCCCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C#N

STK837371
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [2- (trifluoromethyl)phenyl]propanamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534352
Synonyms: 9'- bromo- 2'- [2- (difluoromethoxy)phenyl]- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1ccccc1OC(F)F)Br

STK837374
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (5- methyl- 1,2- oxazol- 3- yl)butanamide
Smiles: O=C(Nc1noc(c1)C)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837377
Synonyms: (5E)- 5- (1H- indol- 3- ylmethylidene)- 1- (tetrahydrofuran- 2- ylmethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1c[nH]c2c1cccc2)CC1CCCO1

STK534359
Synonyms: 2'- {[2- (4- nitrophenyl)hydrazinyl]carbonyl}biphenyl- 2- carboxylicacid
Smiles: O=C(c1ccccc1c1ccccc1C(=O)O)NNc1ccc(cc1)[N+](=O)[O-]

STK837378
Synonyms: 2- methoxyethyl5- [(4- chlorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCc1ccc(cc1)Cl)cc2

STK837379
Synonyms: 7- (4- methoxyphenyl)- 8- methyl- 6- phenyl- 7H- purine
Smiles: COc1ccc(cc1)n1c(C)nc2c1c(ncn2)c1ccccc1

STK534370
Synonyms: 4- ({3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837384
Synonyms: N- [(5Z)- 5- (4- nitrobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 2- phenylacetamide
Smiles: O=C(NN1C(=S)S/C(=C\c2ccc(cc2)[N+](=O)[O-])/C1=O)Cc1ccccc1

STK837385
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 2- oxo- 2H- chromen- 7- ylmethanesulfonate
Smiles: O=c1oc2cc(ccc2cc1c1nc2c(s1)cccc2)OS(=O)(=O)C

STK534373
Synonyms: 9'- bromo- 1- methyl- 2'- (naphthalen- 2- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1ccc2c(c1)cccc2)Br

STK837386
Synonyms: (2Z,5E)- 2,5- bis[2- (difluoromethoxy)benzylidene]cyclopentanone
Smiles: FC(Oc1ccccc1/C=C/1\CC/C(=C/c2ccccc2OC(F)F)/C1=O)F

STK534375
Synonyms: 1,3- dimethyl- 2,6- dioxo- 8- (pyridinium- 1- yl)- 1,2,3,6- tetrahydropurin- 7- ide
Smiles: Cn1c2nc([n-]c2c(=O)n(c1=O)C)[n+]1ccccc1

STK837387
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- fluorophenyl)butanamide
Smiles: O=C(Nc1ccc(cc1)F)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534380
Synonyms: methylN- [(2- amino- 5- methylphenyl)(phenyl)methyl]glycinate
Smiles: COC(=O)CNC(c1cc(C)ccc1N)c1ccccc1

STK837390
Synonyms: (3E)- 2- (morpholin- 4- yl)- 4- phenylbut- 3- enenitrile
Smiles: N#CC(N1CCOCC1)/C=C/c1ccccc1

STK534381
Synonyms: N,N- dimethyl- N'- (2- phenylquinolin- 4- yl)ethane- 1,2- diamine
Smiles: CN(CCNc1cc(nc2c1cccc2)c1ccccc1)C

STK837392
Synonyms: 1- (9H- carbazol- 9- yl)- 3- (2- chlorophenoxy)propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)COc1ccccc1Cl

STK534383
Synonyms: 2- amino- 1- (3,4- dimethylphenyl)- N- (prop- 2- en- 1- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)C)C

STK534385
Synonyms: 8- amino- 3- hexyl- 7- methylbenzo[g]pteridine- 2,4(1H,3H)- dione
Smiles: CCCCCCn1c(=O)[nH]c2c(c1=O)nc1c(n2)cc(c(c1)C)N

STK534386
Synonyms: 4- [5- (3,4- dimethoxyphenyl)- 3- (4- methylphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1cc(ccc1OC)C1CC(=NN1C(=O)CCC(=O)O)c1ccc(cc1)C

STK837394
Synonyms: N- (2- hydroxyphenyl)- 3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccccc1O)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837396
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 7- [(3- chlorobenzyl)oxy]- 2H- chromen- 2- one
Smiles: Clc1cccc(c1)COc1ccc2c(c1)oc(=O)c(c2)c1nc2c(s1)cccc2

STK837397
Synonyms: 3- (4- bromophenyl)- 5- (4- methoxyphenyl)- 1- [(4- methylphenyl)sulfonyl]- 4,5- dihydro- 1H- pyrazole
Smiles: COc1ccc(cc1)C1CC(=NN1S(=O)(=O)c1ccc(cc1)C)c1ccc(cc1)Br

STK534396
Synonyms: 2- (1H- benzimidazol- 2- yl)- 2- [4- (difluoromethoxy)benzyl]- 3- hydroxypropanenitrile
Smiles: OCC(c1nc2c([nH]1)cccc2)(Cc1ccc(cc1)OC(F)F)C#N

STK837402
Synonyms: (3E)- 3- (3,3- dimethyl- 2- oxobutylidene)- 3,4- dihydroquinoxalin- 2(1H)- one
Smiles: O=C(C(C)(C)C)/C=c\1/[nH]c2ccccc2[nH]c1=O

STK837403
Synonyms: N- (4- bromophenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc(cc1)Br)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837405
Synonyms: [3- chloro- 5- phenyl- 7- (trifluoromethyl)- 4,5,6,7- tetrahydropyrazolo[1,5- a]pyrimidin- 2- yl](piperidin- 1- yl)methanone
Smiles: O=C(c1nn2c(c1Cl)NC(CC2C(F)(F)F)c1ccccc1)N1CCCCC1

STK837406
Synonyms: (5Z)- 5- (2- chlorobenzylidene)- 3- [4- (3,4- dihydroquinolin- 1(2H)- yl)- 4- oxobutyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2ccccc2Cl)/C(=O)N1CCCC(=O)N1CCCc2c1cccc2

STK534409
Synonyms: 2- ({3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)benzoicacid
Smiles: O=C(Nc1ccccc1C(=O)O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837408
Synonyms: (2E)- 1- {3- [(2- oxo- 2- phenylethyl)sulfanyl]- 4H- 1,2,4- triazol- 4- yl}- 3- (thiophen- 2- yl)prop- 2- en- 1- one
Smiles: O=C(c1ccccc1)CSc1nncn1C(=O)/C=C/c1cccs1

STK837409
Synonyms: N- (2,3- dimethylphenyl)- 3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1cccc(c1C)C)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK534419
Synonyms: 4- [3- (4- methoxyphenyl)- 5- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1cccs1)C(=O)CCC(=O)O

STK534420
Synonyms: N- (5,6- dimethylthieno[2,3- d]pyrimidin- 4- yl)- L- leucine
Smiles: CC(C[C@@H](C(=O)O)Nc1ncnc2c1c(C)c(s2)C)C

STK534423
Synonyms: 1,3- diphenyl- 1H- indazole- 4,7- dione
Smiles: O=C1C=CC(=O)c2c1c(nn2c1ccccc1)c1ccccc1

STK837413
Synonyms: ethyl4- {4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534427
Synonyms: 2'- (naphthalen- 1- yl)- 1- (propan- 2- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CC(N1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1cccc2c1cccc2)C

STK837414
Synonyms: N- (2,4- dimethylphenyl)- 3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc(cc1C)C)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837415
Synonyms: N- [5- (3- chloropropanoyl)- 10,11- dihydro- 5H- dibenzo[b,f]azepin- 3- yl]- 2- propylpentanamide
Smiles: CCCC(C(=O)Nc1ccc2c(c1)N(C(=O)CCCl)c1ccccc1CC2)CCC

STK837416
Synonyms: 6- chloro- 2,1,3- benzoxadiazole1- oxide
Smiles: [O-][n+]1onc2c1cc(Cl)cc2

STK534436
Synonyms: 2- [3- (4- benzylpiperazin- 1- yl)quinoxalin- 2- yl]- 2- cyano- N- cyclohexylacetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C(=O)NC1CCCCC1

STK534439
Synonyms: 6- methyl- 2,1,3- benzoxadiazole1- oxide
Smiles: [O-][n+]1onc2c1cc(C)cc2

STK837418
Synonyms: N- (2,3- dimethylphenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1cccc(c1C)C)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534441
Synonyms: N- (5,6- dimethylthieno[2,3- d]pyrimidin- 4- yl)- L- methionine
Smiles: CSCC[C@@H](C(=O)O)Nc1ncnc2c1c(C)c(s2)C

STK837420
Synonyms: 3- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,3- dimethylphenyl)propanamide
Smiles: O=C(Nc1cccc(c1C)C)CCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK837421
Synonyms: 2- [(5Z)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [5- (2- methylpropyl)- 1,3,4- thiadiazol- 2- yl]acetamide
Smiles: CC(Cc1nnc(s1)NC(=O)CN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O)C

STK837422
Synonyms: 4- (morpholin- 4- ylsulfonyl)- N- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]benzamide
Smiles: O=C(c1ccc(cc1)S(=O)(=O)N1CCOCC1)Nc1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK534451
Synonyms: 2- cyano- N- cyclohexyl- 2- [3- (4- phenylpiperazin- 1- yl)quinoxalin- 2- yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)c1ccccc1)C(=O)NC1CCCCC1

STK837423
Synonyms: N- (2- ethoxyphenyl)- 3- [(5Z)- 5- (4- methoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: CCOc1ccccc1NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)OC)/C1=O

STK534459
Synonyms: 2- amino- 1- (1,3- benzodioxol- 5- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carbonitrile
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2

STK837426
Synonyms: 4- [(5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- hydroxyphenyl)butanamide
Smiles: O=C(Nc1ccc(cc1)O)CCCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

STK534461
Synonyms: 2- (2- {4- [2- hydroxy- 2- (4- nitrophenyl)ethyl]piperazin- 1- yl}ethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: OC(c1ccc(cc1)[N+](=O)[O-])CN1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK534465
Synonyms: 2- cyano- N- pentyl- 2- [3- (pyrrolidin- 1- yl)quinoxalin- 2- yl]acetamide
Smiles: CCCCCNC(=O)C(c1nc2ccccc2nc1N1CCCC1)C#N

STK534469
Synonyms: N- benzyl- N- ethyl- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: CCN(C(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O)Cc1ccccc1

STK534471
Synonyms: N'- {3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}- 2- methoxybenzohydrazide
Smiles: COc1ccccc1C(=O)NNC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837429
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- ethoxyphenyl)butanamide
Smiles: CCOc1ccccc1NC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534474
Synonyms: 3- [2- amino- 3- (prop- 2- en- 1- ylcarbamoyl)- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl]benzoicacid
Smiles: C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(=O)O

STK837430
Synonyms: N- (2- ethoxyphenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: CCOc1ccccc1NC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534476
Synonyms: N- benzyl- 2- cyano- 2- {3- [4- (4- fluorophenyl)piperazin- 1- yl]quinoxalin- 2- yl}acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)c1ccc(cc1)F)C(=O)NCc1ccccc1

STK534478
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- cyclohexylpropanamide
Smiles: O=C(NC1CCCCC1)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534479
Synonyms: (5Z)- 5- [1- ({3- [(2- ethylhexyl)oxy]propyl}amino)ethylidene]- 1- phenylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCCCC(COCCCN/C(=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1)/C)CC

STK534480
Synonyms: diethyl3- methyl- 5- {[(2E)- 3- (thiophen- 2- yl)prop- 2- enoyl]amino}thiophene- 2,4- dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C=C/c2cccs2)sc(c1C)C(=O)OCC

STK837434
Synonyms: N'- acetyl- 4- [(5E)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanehydrazide
Smiles: O=C(NNC(=O)C)CCCN1C(=S)S/C(=C/c2cccc(c2)Br)/C1=O

STK837435
Synonyms: ethyl4- ({4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534485
Synonyms: 2- ({5- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [3- (morpholin- 4- yl)propyl]acetamide
Smiles: O=C(CSc1nnc(n1c1ccccc1)CSc1nc2c(s1)cccc2)NCCCN1CCOCC1

STK534487
Synonyms: butyl4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CCCCOC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837436
Synonyms: N- cyclohexyl- 3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(NC1CCCCC1)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837438
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- hydroxyphenyl)butanamide
Smiles: O=C(Nc1ccc(cc1)O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837439
Synonyms: (3Z)- 5- bromo- 3- [(2Z)- 4- oxo- 2- {[3- (trifluoromethyl)phenyl]imino}- 1,3- thiazolidin- 5- ylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: Brc1ccc2c(c1)/C(=C\1/S/C(=N\c3cccc(c3)C(F)(F)F)/NC1=O)/C(=O)N2

STK534490
Synonyms: (2- {(Z)- [1- (2- methylphenyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}phenoxy)aceticacid
Smiles: OC(=O)COc1ccccc1/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1C

STK534492
Synonyms: 2- [3- (4- benzylpiperazin- 1- yl)quinoxalin- 2- yl]- 2- cyano- N- (3- methoxypropyl)acetamide
Smiles: COCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C#N

STK837442
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- cyclopentylbutanamide
Smiles: O=C(NC1CCCC1)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837443
Synonyms: (3Z)- 3- [3- (2- fluorophenyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]- 1- methyl- 1,3- dihydro- 2H- indol- 2- one
Smiles: Fc1ccccc1N1C(=S)S/C(=C\2/c3ccccc3N(C2=O)C)/C1=O

STK534497
Synonyms: N- (2- benzyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- L- leucine
Smiles: CC(C[C@@H](C(=O)O)Nc1nc(Cc2ccccc2)nc2c1c1CCCCc1s2)C

STK534498
Synonyms: 1- [5- (4- bromophenyl)- 1',3'- diphenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl]propan- 1- one
Smiles: CCC(=O)N1N=C(CC1c1cn(nc1c1ccccc1)c1ccccc1)c1ccc(cc1)Br

STK534499
Synonyms: N'- {3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}- 2- nitrobenzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1[N+](=O)[O-])CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837445
Synonyms: (5Z)- 5- (2- chlorobenzylidene)- 3- [3- (morpholin- 4- yl)- 3- oxopropyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2ccccc2Cl)/C(=O)N1CCC(=O)N1CCOCC1

STK534500
Synonyms: 2- amino- 1- (2- methoxybenzyl)- N- (1- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccccc1Cn1c2nc3ccccc3nc2c(c1N)C(=O)NC(c1ccccc1)C

STK534502
Synonyms: 5- [5- (4- methoxyphenyl)- 1',3'- diphenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl]- 5- oxopentanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1cn(nc1c1ccccc1)c1ccccc1)C(=O)CCCC(=O)O

STK534504
Synonyms: 2- [(E)- 2- (benzylamino)- 1- nitroethenyl]cyclohexa- 2,5- diene- 1,4- dione
Smiles: O=C1C=CC(=O)C=C1/C(=C\NCc1ccccc1)/[N+](=O)[O-]

STK837448
Synonyms: N- (6- bromo- 2- oxo- 4- phenyl- 1,2- dihydroquinolin- 3- yl)- 2- chlorobenzamide
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(=O)[nH]2)NC(=O)c1ccccc1Cl

STK837450
Synonyms: (5Z)- 3- [3- oxo- 3- (piperidin- 1- yl)propyl]- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2cccs2)/C(=O)N1CCC(=O)N1CCCCC1

STK837451
Synonyms: (2E)- 1- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}- 3- (thiophen- 2- yl)prop- 2- en- 1- one
Smiles: O=C(N1CCN(CC1)C/C=C/c1ccccc1)/C=C/c1cccs1

STK837452
Synonyms: 5- (3,4- dimethoxybenzyl)- 5- [2- (pyridin- 4- yl)ethyl]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cc(ccc1OC)CC1(CCc2ccncc2)C(=O)NC(=O)NC1=O

STK534513
Synonyms: 2- [({5- [(E)- 2- carboxyethenyl]- 2- methoxyphenyl}sulfonyl)amino]benzoicacid
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccccc1C(=O)O)/C=C/C(=O)O

STK534516
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxy- 5- nitrophenyl)propanamide
Smiles: O=C(Nc1cc(ccc1O)[N+](=O)[O-])CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837453
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxy- 4- nitrophenyl)propanamide
Smiles: O=C(Nc1ccc(cc1O)[N+](=O)[O-])CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837455
Synonyms: N- [4- chloro- 2- (phenylcarbonyl)phenyl]- 3- (morpholin- 4- yl)propanamide
Smiles: O=C(Nc1ccc(cc1C(=O)c1ccccc1)Cl)CCN1CCOCC1

STK534527
Synonyms: N- [4- ({2- methoxy- 5- [(Z)- (1- methyl- 4,6- dioxo- 2- thioxotetrahydropyrimidin- 5(2H)- ylidene)methyl]benzyl}oxy)phenyl]acetamide
Smiles: COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=C\1/C(=O)NC(=S)N(C1=O)C

STK837459
Synonyms: 3- [(5Z)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- tert- butylpropanamide
Smiles: O=C(NC(C)(C)C)CCN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O

STK534534
Synonyms: 4- [3- (4- bromophenyl)- 5- (2- fluorophenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccccc1F)c1ccc(cc1)Br

STK534542
Synonyms: 5- [3- (4- bromophenyl)- 5- (furan- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 5- oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccco1)c1ccc(cc1)Br

STK837466
Synonyms: N- (biphenyl- 4- yl)- 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(cc1)c1ccccc1)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837467
Synonyms: N- tert- butyl- 3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(NC(C)(C)C)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837468
Synonyms: 5- (9H- carbazol- 9- ylmethyl)- 1,3- oxazolidin- 2- one
Smiles: O=C1NCC(O1)Cn1c2ccccc2c2c1cccc2

STK534556
Synonyms: [(5E)- 5- (4- ethylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]aceticacid
Smiles: CCc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CC(=O)O

STK837469
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxyethyl)- N- phenylbutanamide
Smiles: OCCN(c1ccccc1)C(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837470
Synonyms: 3- (2- chloro- 6- fluorophenyl)- N- (2- methoxydibenzo[b,d]furan- 3- yl)- 5- methyl- 1,2- oxazole- 4- carboxamide
Smiles: COc1cc2c(cc1NC(=O)c1c(C)onc1c1c(F)cccc1Cl)oc1c2cccc1

STK837471
Synonyms: butyl4- ({3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534566
Synonyms: 1- [6- chloro- 2- (morpholin- 4- yl)- 4- phenylquinolin- 3- yl]ethanone
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(n2)N1CCOCC1)C(=O)C

STK534567
Synonyms: 3- benzylquinoxalin- 2- ol
Smiles: Oc1nc2ccccc2nc1Cc1ccccc1

STK837472
Synonyms: bis(4- methylphenyl)1,3- thiazol- 2- ylphosphoramidate
Smiles: Cc1ccc(cc1)OP(=O)(Nc1nccs1)Oc1ccc(cc1)C

STK837473
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 7- {[(2E)- 3- phenylprop- 2- en- 1- yl]oxy}- 2H- chromen- 2- one
Smiles: O=c1oc2cc(OC/C=C/c3ccccc3)ccc2cc1c1nc2c(s1)cccc2

STK837474
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,3- dimethylphenyl)butanamide
Smiles: O=C(Nc1cccc(c1C)C)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837475
Synonyms: 4,5- bis(4- methoxyphenyl)- 2- (2,4,5- trimethoxyphenyl)- 1H- imidazole
Smiles: COc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)OC)c1cc(OC)c(cc1OC)OC

STK837476
Synonyms: N- (2- bromophenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccccc1Br)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837477
Synonyms: (5E)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 2- (pyridin- 3- ylamino)- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1ccc2c(c1)OCO2)Nc1cccnc1

STK534574
Synonyms: 3- {(E)- [2- (pyridin- 2- yl)hydrazinylidene]methyl}- 1H- indole- 7- carboxylicacid
Smiles: OC(=O)c1cccc2c1[nH]cc2/C=N/Nc1ccccn1

STK837479
Synonyms: 1- (7- methoxy- 3- phenyl- 3,3a,4,5- tetrahydro- 2H- benzo[g]indazol- 2- yl)propan- 1- one
Smiles: CCC(=O)N1N=C2C(C1c1ccccc1)CCc1c2ccc(c1)OC

STK837480
Synonyms: N'- {4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}- 2- hydroxybenzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534579
Synonyms: 3- [2- amino- 3- (butylcarbamoyl)- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl]benzoicacid
Smiles: CCCCNC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(=O)O

STK837482
Synonyms: ethyl5- [(4- fluorobenzyl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccc(cc1)F)cc2)c1ccccc1

STK534588
Synonyms: propyl4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CCCOC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534589
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N'- phenylpropanehydrazide
Smiles: O=C(CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O)NNc1ccccc1

STK534591
Synonyms: 2- [(5Z)- 5- (1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanedioicacid
Smiles: OC(=O)CC(N1C(=S)S/C(=C\2/c3ccccc3N(C2=O)C)/C1=O)C(=O)O

STK837484
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- ethoxyphenyl)propanamide
Smiles: CCOc1ccccc1NC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837485
Synonyms: N- tert- butyl- 4- [(5Z)- 5- (4- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(NC(C)(C)C)CCCN1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O

STK534597
Synonyms: {[5- (1,3- benzodioxol- 5- yl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1nnc(n1c1ccccc1)c1ccc2c(c1)OCO2

STK837487
Synonyms: 2- (4- methoxyphenyl)- 4,5- bis(4- methylphenyl)- 1H- imidazole
Smiles: COc1ccc(cc1)c1[nH]c(c(n1)c1ccc(cc1)C)c1ccc(cc1)C

STK534602
Synonyms: (1S,8aS)- 4- amino- 1- (thiophen- 2- yl)- 6,7,8,8a- tetrahydronaphthalene- 2,2,3(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C2=CCCC[C@H]2[C@@H](C1(C#N)C#N)c1cccs1

STK534605
Synonyms: 2- (diphenylphosphoryl)- 4- (2- ethoxyethoxy)butanoicacid
Smiles: CCOCCOCCC(P(=O)(c1ccccc1)c1ccccc1)C(=O)O

STK837488
Synonyms: N- (2- chlorophenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccccc1Cl)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837489
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [3- (morpholin- 4- yl)propyl]propanamide
Smiles: O=C(CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O)NCCCN1CCOCC1

STK534609
Synonyms: N- benzyl- 2- cyano- 2- [3- (3,5- dimethylpiperidin- 1- yl)quinoxalin- 2- yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CC(C)CC(C1)C)C(=O)NCc1ccccc1

STK837490
Synonyms: propyl4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoate
Smiles: CCCOC(=O)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837491
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (pyridin- 3- yl)butanamide
Smiles: O=C(Nc1cccnc1)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534611
Synonyms: 11- (3,5- dimethylphenyl)- 3- (2- methoxyethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cc(C)cc(c1)C

STK837492
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [3- (trifluoromethyl)phenyl]propanamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534612
Synonyms: N- tert- butyl- 3- {(5Z)- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}propanamide
Smiles: O=C(NC(C)(C)C)CCN1C(=S)S/C(=C\C(=C\c2ccccc2)\C)/C1=O

STK534613
Synonyms: 5- (4- bromophenyl)- 2- (3,4- dichlorophenyl)- 4- phenyl- 1H- imidazole
Smiles: Brc1ccc(cc1)c1[nH]c(nc1c1ccccc1)c1ccc(c(c1)Cl)Cl

STK837493
Synonyms: ethyl5- [(2- fluorobenzyl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccccc1F)cc2)c1ccccc1

STK837494
Synonyms: 2- [5- methyl- 3- (trifluoromethyl)- 1H- pyrazol- 1- yl]acetamide
Smiles: NC(=O)Cn1nc(cc1C)C(F)(F)F

STK837495
Synonyms: 4- [(5Z)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxyphenyl)butanamide
Smiles: O=C(Nc1ccccc1O)CCCN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O

STK534620
Synonyms: 1- methyl- N'- [(E)- (4- nitrophenyl)methylidene]- 1H- indole- 3- carbohydrazide
Smiles: O=C(c1cn(c2c1cccc2)C)N/N=C/c1ccc(cc1)[N+](=O)[O-]

STK534621
Synonyms: 5- (diphenylmethyl)- 6- hydroxy- 2- (propylsulfanyl)pyrimidin- 4(3H)- one
Smiles: CCCSc1nc(O)c(c(=O)[nH]1)C(c1ccccc1)c1ccccc1

STK534623
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (naphthalen- 1- yl)propanamide
Smiles: O=C(Nc1cccc2c1cccc2)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534625
Synonyms: N- (2- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- L- alanine
Smiles: OC(=O)[C@@H](Nc1nc(C)nc2c1c1CCCCc1s2)C

STK837498
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [2- (trifluoromethyl)phenyl]propanamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837499
Synonyms: propyl3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoate
Smiles: CCCOC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534629
Synonyms: N- (4- bromo- 2- {[(2- hydrazinyl- 2- oxoethyl)amino](phenyl)methyl}phenyl)- 4- methoxybenzamide(non- preferredname)
Smiles: NNC(=O)CNC(c1cc(Br)ccc1NC(=O)c1ccc(cc1)OC)c1ccccc1

STK837501
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (3- fluorophenyl)propanamide
Smiles: O=C(Nc1cccc(c1)F)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837502
Synonyms: 4,5- diphenyl- 2- [3- (phenylethynyl)phenyl]- 1H- imidazole
Smiles: c1ccc(cc1)C#Cc1cccc(c1)c1nc(c([nH]1)c1ccccc1)c1ccccc1

STK837503
Synonyms: N- (4- methoxyphenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: COc1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837505
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,4,6- trimethylphenyl)butanamide
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1c(C)cc(cc1C)C

STK534636
Synonyms: 2- [(5Z)- 5- {[5- (3,4- dichlorophenyl)furan- 2- yl]methylidene}- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoicacid
Smiles: OC(=O)C(N1C(=S)S/C(=C\c2ccc(o2)c2ccc(c(c2)Cl)Cl)/C1=O)C

STK534640
Synonyms: N'- {3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}- 4- methylbenzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)C)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534643
Synonyms: (2E)- 2- cyano- 3- [(3- fluorophenyl)amino]but- 2- enamide
Smiles: N#C/C(=C(\Nc1cccc(c1)F)/C)/C(=O)N

STK534647
Synonyms: N- butyl- 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: CCCCNC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837508
Synonyms: 1- (9H- carbazol- 9- yl)- 3- (2,6- dimethylphenoxy)propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)COc1c(C)cccc1C

STK534649
Synonyms: N- benzyl- N- ethyl- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: CCN(C(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O)Cc1ccccc1

STK837509
Synonyms: (5Z)- 3- (4- hydroxyphenyl)- 5- (4- methylbenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)O

STK837510
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [2- (trifluoromethyl)phenyl]butanamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534657
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (pyridin- 2- yl)butanamide
Smiles: O=C(Nc1ccccn1)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534658
Synonyms: 2- hydroxy- 4- [(quinolin- 8- ylsulfonyl)amino]benzoicacid
Smiles: OC(=O)c1ccc(cc1O)NS(=O)(=O)c1cccc2c1nccc2

STK837511
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- ethoxyphenyl)propanamide
Smiles: CCOc1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837512
Synonyms: 1- (4- methoxyphenyl)- 6- methyl- 5- (phenylcarbonyl)- 3,4- dihydropyridin- 2(1H)- one
Smiles: COc1ccc(cc1)N1C(=O)CCC(=C1C)C(=O)c1ccccc1

STK837513
Synonyms: (5Z)- 5- (4- bromobenzylidene)- 2- [(4- fluorophenyl)amino]- 1,3- thiazol- 4(5H)- one
Smiles: Fc1ccc(cc1)NC1=NC(=O)/C(=C/c2ccc(cc2)Br)/S1

STK837515
Synonyms: N- (2- hydroxyethyl)- 3- [(5E)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- phenylpropanamide
Smiles: OCCN(c1ccccc1)C(=O)CCN1C(=S)S/C(=C/c2cccs2)/C1=O

STK837516
Synonyms: (2E)- 3- [4- methoxy- 3- (piperidin- 1- ylsulfonyl)phenyl]- N- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enamide
Smiles: COc1ccc(cc1S(=O)(=O)N1CCCCC1)/C=C/C(=O)Nc1scc(n1)c1ccccc1

STK837517
Synonyms: 2- [(5Z)- 5- (3- bromobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O)Nc1nccs1

STK534664
Synonyms: N- [3- (quinolin- 6- ylamino)quinoxalin- 2- yl]benzenesulfonamide
Smiles: O=S(=O)(c1ccccc1)Nc1nc2ccccc2nc1Nc1ccc2c(c1)cccn2

STK837520
Synonyms: 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- phenylethyl)propanamide
Smiles: O=C(CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O)NCCc1ccccc1

STK837524
Synonyms: N- (4- acetylphenyl)- 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837525
Synonyms: (5Z)- 3- [4- (4- benzylpiperidin- 1- yl)- 4- oxobutyl]- 5- (4- methylbenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N1CCC(CC1)Cc1ccccc1

STK534673
Synonyms: 3- (3- phenylpyridazino[3,4- b]quinoxalin- 5(10H)- yl)propylacetate
Smiles: CC(=O)OCCCn1c2cc(nnc2[nH]c2c1cccc2)c1ccccc1

STK837527
Synonyms: N- (2- hydroxy- 4- nitrophenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(cc1O)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837528
Synonyms: N- [(5Z)- 5- (4- hydroxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 4- nitrobenzamide
Smiles: Oc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)[N+](=O)[O-]

STK837530
Synonyms: (5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 3- [3- (3,4- dihydroquinolin- 1(2H)- yl)- 3- oxopropyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1CCC(=O)N1CCCc2c1cccc2

STK534677
Synonyms: piperidin- 1- yl[10- (piperidin- 1- yl)- 10,11- dihydro- 5H- dibenzo[b,f]azepin- 5- yl]methanone
Smiles: O=C(N1c2ccccc2CC(c2c1cccc2)N1CCCCC1)N1CCCCC1

STK534679
Synonyms: 11- (3- chlorophenyl)- 3- (2- methoxyethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(c1)Cl

STK837531
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (3- fluorophenyl)butanamide
Smiles: O=C(Nc1cccc(c1)F)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534680
Synonyms: (5E)- 5- (3- bromobenzylidene)- 3- [3- (2- ethylpiperidin- 1- yl)- 3- oxopropyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCC1CCCCN1C(=O)CCN1C(=S)S/C(=C/c2cccc(c2)Br)/C1=O

STK534681
Synonyms: [3- (2- chloro- 6- fluorophenyl)- 5- methyl- 1,2- oxazol- 4- yl][4- (pyridin- 2- yl)piperazin- 1- yl]methanone
Smiles: Cc1onc(c1C(=O)N1CCN(CC1)c1ccccn1)c1c(F)cccc1Cl

STK837532
Synonyms: (2E)- N- [2- (morpholin- 4- yl)ethyl]- 3- (thiophen- 2- yl)prop- 2- enamide
Smiles: O=C(/C=C/c1cccs1)NCCN1CCOCC1

STK534682
Synonyms: 1,3- dimethyl- 5- [(piperidin- 1- ylamino)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CN1C(=O)N(C)C(=O)C(=CNN2CCCCC2)C1=O

STK534694
Synonyms: 9- methoxy- 5- (3- nitrophenyl)- 2- phenyl- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc2c(c1)C1CC(=NN1C(O2)c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK534697
Synonyms: 4- ({3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534698
Synonyms: (2E)- 3- [4- methoxy- 3- (pyrrolidin- 1- ylsulfonyl)phenyl]prop- 2- enoicacid
Smiles: COc1ccc(cc1S(=O)(=O)N1CCCC1)/C=C/C(=O)O

STK837537
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- nitrophenyl)butanamide
Smiles: O=C(Nc1ccccc1[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837538
Synonyms: ethyl2- phenyl- 5- [(phenylcarbonyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccccc1)c1ccccc1

STK837539
Synonyms: 2,7- bis(pyrrolidin- 1- ylsulfonyl)- 9H- fluoren- 9- one
Smiles: O=C1c2cc(ccc2c2c1cc(cc2)S(=O)(=O)N1CCCC1)S(=O)(=O)N1CCCC1

STK534707
Synonyms: N'- {4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}- 3- hydroxybenzohydrazide
Smiles: O=C(NNC(=O)c1cccc(c1)O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837540
Synonyms: (5Z)- 5- (2- chlorobenzylidene)- 3- [4- (morpholin- 4- yl)- 4- oxobutyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2ccccc2Cl)/C(=O)N1CCCC(=O)N1CCOCC1

STK534712
Synonyms: 2- amino- 1- cyclohexyl- N- [2- (4- fluorophenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Fc1ccc(cc1)CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)C1CCCCC1

STK837542
Synonyms: ethyl5- methyl- 3- {2- [(4- methylphenyl)amino]- 2- oxoethyl}- 4- oxo- 3,4- dihydrothieno[3,4- d][1,2,3]triazine- 7- carboxylate
Smiles: CCOC(=O)c1sc(c2c1nnn(c2=O)CC(=O)Nc1ccc(cc1)C)C

STK534718
Synonyms: (3Z)- 3- ({[3- (dimethylamino)propyl]amino}methylidene)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CN(CCCN/C=C/1\C(=O)Nc2c1cccc2)C

STK837544
Synonyms: N- {3- [(3- fluorophenyl)amino]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Fc1cccc(c1)Nc1nc2ccccc2nc1NS(=O)(=O)c1ccccc1

STK534720
Synonyms: 4- [(5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxyphenyl)butanamide
Smiles: O=C(Nc1ccccc1O)CCCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

STK534722
Synonyms: ethyl4- {3- [2- (butylamino)- 1- cyano- 2- oxoethyl]quinoxalin- 2- yl}piperazine- 1- carboxylate
Smiles: CCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(=O)OCC)C#N

STK534723
Synonyms: 2- methoxy- N'- {4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}benzohydrazide
Smiles: COc1ccccc1C(=O)NNC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534728
Synonyms: N- {4- [(2- methoxy- 5- {(Z)- [1- (4- methoxybenzyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}benzyl)oxy]phenyl}acetamide
Smiles: COc1ccc(cc1)CN1C(=O)NC(=O)/C(=C/c2ccc(c(c2)COc2ccc(cc2)NC(=O)C)OC)/C1=O

STK837547
Synonyms: [4- (piperidin- 1- ylsulfonyl)phenyl][2- (prop- 2- yn- 1- ylsulfanyl)- 1H- benzimidazol- 1- yl]methanone
Smiles: C#CCSc1nc2c(n1C(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1)cccc2

STK534736
Synonyms: 2- chloro- 1- [5- (2,3- dimethoxyphenyl)- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]ethanone
Smiles: ClCC(=O)N1N=C(CC1c1cccc(c1OC)OC)c1cccs1

STK534738
Synonyms: 2- (2- {4- [(3- chloro- 6- methoxy- 1- benzothiophen- 2- yl)carbonyl]piperazin- 1- yl}ethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: COc1ccc2c(c1)sc(c2Cl)C(=O)N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK534743
Synonyms: N'- {3- [(5E)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}- 3- hydroxybenzohydrazide
Smiles: O=C(NNC(=O)c1cccc(c1)O)CCN1C(=S)S/C(=C/c2ccc3c(c2)OCO3)/C1=O

STK534744
Synonyms: 2- [(Z)- (2,4- dichlorobenzylidene)(oxido)- lambda~5~- azanyl]- 2- methylpropanenitrile
Smiles: N#CC(/[N+](=C/c1ccc(cc1Cl)Cl)/[O-])(C)C

STK534748
Synonyms: 3- hydroxy- N'- {3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1cccc(c1)O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534750
Synonyms: ethyl4- (3- {1- cyano- 2- oxo- 2- [(2- phenylethyl)amino]ethyl}quinoxalin- 2- yl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc2ccccc2nc1C(C(=O)NCCc1ccccc1)C#N

STK534753
Synonyms: 7- hydroxy- 3- (1- methyl- 1H- benzimidazol- 2- yl)- 8- (piperidin- 1- ylmethyl)- 2H- chromen- 2- one
Smiles: Oc1ccc2c(c1CN1CCCCC1)oc(=O)c(c2)c1nc2c(n1C)cccc2

STK837554
Synonyms: N- (4- fluorophenyl)- 5- oxo- 9b- phenyl- 2,3,5,9b- tetrahydro- 1H- imidazo[2,1- a]isoindole- 1- carboxamide
Smiles: Fc1ccc(cc1)NC(=O)N1CCN2C1(c1ccccc1)c1ccccc1C2=O

STK837555
Synonyms: N- cyclohexyl- N- (2- phenoxyethyl)- 2,1,3- benzothiadiazole- 4- sulfonamide
Smiles: O=S(=O)(c1cccc2c1nsn2)N(C1CCCCC1)CCOc1ccccc1

STK534759
Synonyms: {4- [(E)- {1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene}methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccc(cc1)/C=C/1\C(=O)NC(=O)N(C1=O)CCC1=CCCCC1

STK534760
Synonyms: N- [3- (4- methylpiperazin- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]benzenesulfonamide
Smiles: CN1CCN(CC1)C1=C(NS(=O)(=O)c2ccccc2)C(=O)c2c(C1=O)cccc2

STK534763
Synonyms: 2- cyano- 2- {3- [4- (4- fluorophenyl)piperazin- 1- yl]quinoxalin- 2- yl}- N- pentylacetamide
Smiles: CCCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)c1ccc(cc1)F)C#N

STK534765
Synonyms: 2- amino- 1- [2- (2- fluorophenyl)ethyl]- N- [2- (morpholin- 4- yl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1F)NCCN1CCOCC1

STK837556
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (pyridin- 3- yl)butanamide
Smiles: O=C(Nc1cccnc1)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534770
Synonyms: N- (4- chloro- 2- {[(2- hydrazinyl- 2- oxoethyl)amino](phenyl)methyl}phenyl)benzamide(non- preferredname)
Smiles: NNC(=O)CNC(c1cc(Cl)ccc1NC(=O)c1ccccc1)c1ccccc1

STK534772
Synonyms: N,N'- (1R,2S)- cyclohexane- 1,2- diylbis{N- [(Z)- (5- nitrofuran- 2- yl)methylidene]amineoxide}
Smiles: [O-]/[N+](=C\c1ccc(o1)[N+](=O)[O-])/[C@@H]1CCCC[C@@H]1/[N+](=C/c1ccc(o1)[N+](=O)[O-])/[O-]

STK837561
Synonyms: (5E)- 1- (2- fluorophenyl)- 5- [(5- methylfuran- 2- yl)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(o1)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccccc1F

STK837563
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxy- 4- nitrophenyl)butanamide
Smiles: O=C(Nc1ccc(cc1O)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534778
Synonyms: {[4- phenyl- 5- (thiophen- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1nnc(n1c1ccccc1)c1cccs1

STK534779
Synonyms: N'- [1- (1,3- dimethyl- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene)propyl]pentanehydrazide
Smiles: CCC(=C1C(=O)N(C)C(=O)N(C1=O)C)NNC(=O)CCCC

STK837566
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 7- [(2,4- dichlorobenzyl)oxy]- 2H- chromen- 2- one
Smiles: Clc1ccc(c(c1)Cl)COc1ccc2c(c1)oc(=O)c(c2)c1nc2c(s1)cccc2

STK837567
Synonyms: N- {(5Z)- 4- oxo- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 2- thioxo- 1,3- thiazolidin- 3- yl}- 2- phenylacetamide
Smiles: O=C(NN1C(=S)S/C(=C\C=C\c2ccccc2)/C1=O)Cc1ccccc1

STK837568
Synonyms: ethyl5- {[(2- methoxyphenyl)carbonyl]oxy}- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccccc1OC)c1ccccc1

STK837570
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxyphenyl)butanamide
Smiles: O=C(Nc1ccccc1O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534790
Synonyms: 9'- bromo- 1- methyl- 2'- (naphthalen- 1- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1cccc2c1cccc2)Br

STK837572
Synonyms: N- [6- (methylsulfonyl)- 1,3- benzothiazol- 2- yl]- 4- (morpholin- 4- ylsulfonyl)benzamide
Smiles: O=C(c1ccc(cc1)S(=O)(=O)N1CCOCC1)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C

STK837574
Synonyms: 4- [(5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (3- hydroxyphenyl)butanamide
Smiles: O=C(Nc1cccc(c1)O)CCCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

STK837575
Synonyms: N- [3- (9H- carbazol- 9- yl)- 2- hydroxypropyl]- N- (4- chlorophenyl)methanesulfonamide
Smiles: OC(CN(S(=O)(=O)C)c1ccc(cc1)Cl)Cn1c2ccccc2c2c1cccc2

STK837580
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- nitrophenyl)butanamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837581
Synonyms: 7,7'- [(3- nitrophenyl)methanediyl]bis(8- hydroxy- 3,4- dihydro- 2H,6H- pyrimido[2,1- b][1,3]thiazin- 6- one)
Smiles: Oc1nc2SCCCn2c(=O)c1[C@H](c1c(O)nc2n(c1=O)CCCS2)c1cccc(c1)[N+](=O)[O-]

STK534810
Synonyms: 1- (2,4- dichlorophenyl)- 3- [1,1,1- trichloro- 4- (4- nitrophenyl)- 4- oxobutan- 2- yl]urea
Smiles: O=C(NC(C(Cl)(Cl)Cl)CC(=O)c1ccc(cc1)[N+](=O)[O-])Nc1ccc(cc1Cl)Cl

STK534811
Synonyms: 1,4- bis[(2- chlorobenzyl)oxy]- 3,3,6,6- tetramethylpiperazine- 2,5- dione
Smiles: O=C1N(OCc2ccccc2Cl)C(C)(C)C(=O)N(C1(C)C)OCc1ccccc1Cl

STK534812
Synonyms: 3- [({5- [(E)- 2- carboxyethenyl]- 2- methoxyphenyl}sulfonyl)amino]benzoicacid
Smiles: COc1ccc(cc1S(=O)(=O)Nc1cccc(c1)C(=O)O)/C=C/C(=O)O

STK534814
Synonyms: 2- ({4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}amino)benzoicacid
Smiles: O=C(Nc1ccccc1C(=O)O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837586
Synonyms: ethyl5- [(furan- 2- ylcarbonyl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccco1)c1ccccc1

STK837588
Synonyms: N- (3,4- dimethylphenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837589
Synonyms: (5Z)- 5- (4- methylbenzylidene)- 3- [3- oxo- 3- (pyrrolidin- 1- yl)propyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)N1CCCC1

STK534823
Synonyms: 7- chloro- 4- nitro- 5- phenyltetrazolo[1,5- a]quinoline
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c1n2nnn1)[N+](=O)[O-]

STK534826
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (3,5- dichlorophenyl)propanamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837592
Synonyms: 1- (9H- carbazol- 9- yl)- 3- [(2,3- dimethylphenyl)amino]propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CNc1cccc(c1C)C

STK534828
Synonyms: 1,3- dimethyl- 5- [(piperidin- 1- ylamino)methylidene]- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: CN1C(=S)N(C)C(=O)C(=CNN2CCCCC2)C1=O

STK534831
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (4- methylphenyl)butanamide
Smiles: O=C(Nc1ccc(cc1)C)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534837
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,4,5- trichlorophenyl)butanamide
Smiles: O=C(Nc1cc(Cl)c(cc1Cl)Cl)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534842
Synonyms: 3- (3- chloro- 10,11- dihydro- 5H- dibenzo[b,f]azepin- 5- yl)- N,N- dimethylpropan- 1- amine
Smiles: CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C

STK837595
Synonyms: ethyl5- acetyl- 4- methyl- 2- {[(2E)- 3- (thiophen- 2- yl)prop- 2- enoyl]amino}thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C=C/c2cccs2)sc(c1C)C(=O)C

STK534852
Synonyms: N- [2- (2- amino- 3- cyano- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl)ethyl]- 4- bromobenzamide
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)CCNC(=O)c1ccc(cc1)Br

STK837598
Synonyms: 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]acetamide
Smiles: NC(=O)Cc1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK837599
Synonyms: [5- (2- methoxyphenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl](phenyl)methanone
Smiles: COc1ccccc1C1CC(=NN1C(=O)c1ccccc1)c1ccccc1

STK534858
Synonyms: 9'- bromo- 1- methyl- 2'- (thiophen- 2- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1cccs1)Br

STK534859
Synonyms: 3- (1H- benzimidazol- 2- yl)- 7- hydroxy- 8- [(4- methylpiperidin- 1- yl)methyl]- 2H- chromen- 2- one
Smiles: CC1CCN(CC1)Cc1c(O)ccc2c1oc(=O)c(c2)c1nc2c([nH]1)cccc2

STK837602
Synonyms: 1- [(4- fluorophenyl)carbonyl]- 9b- phenyl- 1,2,3,9b- tetrahydro- 5H- imidazo[2,1- a]isoindol- 5- one
Smiles: Fc1ccc(cc1)C(=O)N1CCN2C1(c1ccccc1)c1ccccc1C2=O

STK837603
Synonyms: methyl4- [(Z)- {3- [3- (3,4- dihydroquinolin- 1(2H)- yl)- 3- oxopropyl]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)N1CCCc2c1cccc2

STK534867
Synonyms: (2E)- 3- {3- [(2- hydroxyethyl)sulfamoyl]- 4- methoxyphenyl}prop- 2- enoicacid
Smiles: OCCNS(=O)(=O)c1cc(/C=C/C(=O)O)ccc1OC

STK534868
Synonyms: 4- methyl- N'- {4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)C)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837608
Synonyms: benzyl{[3- (1,3- benzothiazol- 2- yl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetate
Smiles: O=C(COc1ccc2c(c1)oc(c(c2=O)c1nc2c(s1)cccc2)C)OCc1ccccc1

STK534870
Synonyms: 4- [5- (4- methoxyphenyl)- 1',3'- diphenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl]- 4- oxobutanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1cn(nc1c1ccccc1)c1ccccc1)C(=O)CCC(=O)O

STK534874
Synonyms: 9'- bromo- 2'- [4- (difluoromethoxy)phenyl]- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1ccc(cc1)OC(F)F)Br

STK534884
Synonyms: N- benzyl- 3- [(5Z)- 5- (4- ethoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- methylpropanamide
Smiles: CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)N(Cc1ccccc1)C

STK837613
Synonyms: [3- (4- bromophenyl)- 5- (2- methoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl](phenyl)methanone
Smiles: COc1ccccc1C1CC(=NN1C(=O)c1ccccc1)c1ccc(cc1)Br

STK837615
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (naphthalen- 2- yl)butanamide
Smiles: O=C(Nc1ccc2c(c1)cccc2)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534887
Synonyms: [(2- hydroxyphenoxy)methyl]phosphonicacid
Smiles: Oc1ccccc1OCP(=O)(O)O

STK534891
Synonyms: (5Z)- 5- {[(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)amino]methylidene}- 1- (4- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/Nc2c(=O)n(n(c2C)C)c2ccccc2)/C1=O

STK534892
Synonyms: (5Z,5'Z)- 3,3'- [piperazine- 1,4- diylbis(3- oxopropane- 3,1- diyl)]bis[5- (4- methylbenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one]
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)N1CCN(CC1)C(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534894
Synonyms: (2E)- 1- [4- (difluoromethoxy)phenyl]- 3- (2- hydroxyphenyl)prop- 2- en- 1- one
Smiles: FC(Oc1ccc(cc1)C(=O)/C=C/c1ccccc1O)F

STK534902
Synonyms: 4- (10- iodo- 1H- phenanthro[9,10- d]imidazol- 2- yl)phenol
Smiles: Oc1ccc(cc1)c1nc2c([nH]1)c1cc(I)ccc1c1c2cccc1

STK837620
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- hydroxyphenyl)propanamide
Smiles: O=C(Nc1ccccc1O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837622
Synonyms: ethyl5- [(2- chloro- 6- fluorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCc1c(F)cccc1Cl)cc2

STK837623
Synonyms: methyl[6- bromo- 4- (2- chlorophenyl)- 2- oxo- 1,4- dihydroquinazolin- 3(2H)- yl]acetate
Smiles: COC(=O)CN1C(=O)Nc2c(C1c1ccccc1Cl)cc(cc2)Br

STK837624
Synonyms: N- (3- bromophenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1cccc(c1)Br)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837626
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 6- ethyl- 7- methoxy- 2- methyl- 4H- chromen- 4- one
Smiles: CCc1cc2c(cc1OC)oc(c(c2=O)c1nc2c(s1)cccc2)C

STK837627
Synonyms: (5E)- 5- [(5- methylthiophen- 2- yl)methylidene]- 1- (tetrahydrofuran- 2- ylmethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)/C(=C\c2ccc(s2)C)/C(=O)N1CC1CCCO1

STK837629
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 6- ethyl- 4- oxo- 4H- chromen- 7- yl4- methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1cc2occ(c(=O)c2cc1CC)c1nc2c(s1)cccc2

STK534917
Synonyms: (5Z)- 1- methyl- 5- [(5- nitrofuran- 2- yl)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CN1C(=O)NC(=O)/C(=C/c2ccc(o2)[N+](=O)[O-])/C1=O

STK534918
Synonyms: 2'- (2- chlorophenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccccc1Cl

STK534926
Synonyms: 2- {(5Z)- 5- [4- (methoxycarbonyl)benzylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}propanoicacid
Smiles: COC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C

STK534927
Synonyms: N'- {3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}- 4- nitrobenzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)[N+](=O)[O-])CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534931
Synonyms: 6- {(5Z)- 5- [4- (methoxycarbonyl)benzylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}hexanoicacid
Smiles: COC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCCCC(=O)O

STK837634
Synonyms: 5- (3,4- dimethoxyphenyl)- 2- (4- methoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC2c1ccc(c(c1)OC)OC

STK534932
Synonyms: 6- methyl- 4- oxo- 3- phenyl- 3,4- dihydrothieno[3,2- d]pyrimidine- 7- carboxamide
Smiles: NC(=O)c1c(C)sc2c1ncn(c2=O)c1ccccc1

STK534933
Synonyms: {4- [(E)- (1- cyclohexyl- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene)methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccc(cc1)/C=C/1\C(=O)NC(=O)N(C1=O)C1CCCCC1

STK837635
Synonyms: 9b- (4- chlorophenyl)- N- (2,4- difluorophenyl)- 5- oxo- 2,3,5,9b- tetrahydro- 1H- imidazo[2,1- a]isoindole- 1- carboxamide
Smiles: Clc1ccc(cc1)C12N(CCN1C(=O)c1c2cccc1)C(=O)Nc1ccc(cc1F)F

STK837636
Synonyms: methyl2- methyl- 5- [(pentafluorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(OCc1c(F)c(F)c(c(c1F)F)F)cc2

STK534936
Synonyms: 2- amino- 1- (4- methoxybenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carbonitrile
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)OC

STK534938
Synonyms: ethyl2,5- dimethyl- 2- (naphthalen- 1- yl)- 4- oxo- 1,2,3,4- tetrahydrothieno[3,4- d]pyrimidine- 7- carboxylate
Smiles: CCOC(=O)c1sc(c2c1NC(C)(NC2=O)c1cccc2c1cccc2)C

STK837637
Synonyms: N- (3- methoxyphenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: COc1cccc(c1)NC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534942
Synonyms: 2- amino- 1- benzyl- N- [2- (morpholin- 4- yl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1)NCCN1CCOCC1

STK534946
Synonyms: [6- bromo- 4- (2- chlorophenyl)- 2- oxo- 1,2- dihydroquinolin- 3- yl]aceticacid
Smiles: OC(=O)Cc1c(=O)[nH]c2c(c1c1ccccc1Cl)cc(cc2)Br

STK534950
Synonyms: 1- (4- nitrophenyl)- 2- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}ethanol
Smiles: OC(c1ccc(cc1)[N+](=O)[O-])CN1CCN(CC1)C/C=C/c1ccccc1

STK534958
Synonyms: 7- methoxy- 4- nitro- 2,1,3- benzoxadiazole1- oxide
Smiles: COc1ccc(c2c1[n+]([O-])on2)[N+](=O)[O-]

STK837641
Synonyms: N- (1,3- benzodioxol- 5- yl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534960
Synonyms: N'- {3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}- 2- nitrobenzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1[N+](=O)[O-])CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837644
Synonyms: ethyl4- ({3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837647
Synonyms: N- (2- bromophenyl)- 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccccc1Br)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534968
Synonyms: ethyl4- {1,4- dioxo- 3- [(phenylsulfonyl)amino]- 1,4- dihydronaphthalen- 2- yl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C1=C(NS(=O)(=O)c2ccccc2)C(=O)c2c(C1=O)cccc2

STK534974
Synonyms: N- (6,7- dihydro- 5H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 4- yl)- L- leucine
Smiles: CC(C[C@@H](C(=O)O)Nc1ncnc2c1c1CCCc1s2)C

STK534976
Synonyms: (5Z)- 5- (furan- 3- ylmethylidene)- 1- (3- methylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1cccc(c1)N1C(=O)NC(=O)/C(=C/c2ccoc2)/C1=O

STK534978
Synonyms: 2- cyano- 2- {3- [4- (4- fluorophenyl)piperazin- 1- yl]quinoxalin- 2- yl}- N- hexylacetamide
Smiles: CCCCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)c1ccc(cc1)F)C#N

STK534982
Synonyms: N- (2- methoxyphenyl)- 4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: COc1ccccc1NC(=O)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837652
Synonyms: N- (2,3- dichlorophenyl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1cccc(c1Cl)Cl)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534985
Synonyms: 3,3'- [9H- fluorene- 9,9- diylbis(benzene- 4,1- diyloxy)]bis[1- (morpholin- 4- yl)propan- 2- ol]
Smiles: OC(CN1CCOCC1)COc1ccc(cc1)C1(c2ccc(cc2)OCC(CN2CCOCC2)O)c2ccccc2c2c1cccc2

STK837653
Synonyms: 4- chloro- N- (6,7,8,9- tetrahydro- 5H- [1,2,4]triazolo[4,3- a]azepin- 3- ylmethyl)aniline
Smiles: Clc1ccc(cc1)NCc1nnc2n1CCCCC2

STK534986
Synonyms: N- (2- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- L- isoleucine
Smiles: CC[C@@H]([C@@H](C(=O)O)Nc1nc(C)nc2c1c1CCCCc1s2)C

STK534987
Synonyms: 5,6,7,8- tetrahydro[1,3]dithiolo[4,5- b][1,4]dithiocine- 2- thione
Smiles: S=c1sc2c(s1)SCCCCS2

STK534988
Synonyms: 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- methylphenyl)butanamide
Smiles: O=C(Nc1ccccc1C)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK534991
Synonyms: N- (2,4- dimethylphenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1ccc(cc1C)C

STK534993
Synonyms: 4- {(5E)- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}butanoicacid
Smiles: C/C(=C\c1ccccc1)/C=C\1/SC(=S)N(C1=O)CCCC(=O)O

STK534995
Synonyms: 3- [(5Z)- 5- (4- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N'- [(4- methylphenyl)sulfonyl]propanehydrazide
Smiles: O=C(NNS(=O)(=O)c1ccc(cc1)C)CCN1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O

STK535005
Synonyms: N- (3- chlorophenyl)- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1cccc(c1)Cl)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837659
Synonyms: (5Z)- 5- (4- ethoxybenzylidene)- 3- [2- oxo- 2- (pyrrolidin- 1- yl)ethyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CC(=O)N1CCCC1

STK535008
Synonyms: N- (4- bromophenyl)- 2- [(5- ethyl- 4- hydroxy- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]acetamide
Smiles: CCc1c(O)nc([nH]c1=O)SCC(=O)Nc1ccc(cc1)Br

STK535009
Synonyms: 2- chloro- N'- {3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1Cl)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837662
Synonyms: methyl3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoate
Smiles: COC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK535015
Synonyms: N- (5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- L- glutamicacid
Smiles: OC(=O)CC[C@@H](C(=O)O)Nc1ncnc2c1c1CCCCc1s2

STK837664
Synonyms: N- (3- methoxyphenyl)- 4- [(5E)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: COc1cccc(c1)NC(=O)CCCN1C(=S)S/C(=C/c2cccs2)/C1=O

STK837665
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 7- [(3,4- dichlorobenzyl)oxy]- 2H- chromen- 2- one
Smiles: O=c1oc2cc(OCc3ccc(c(c3)Cl)Cl)ccc2cc1c1nc2c(s1)cccc2

STK535020
Synonyms: N'- {4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}pyridine- 3- carbohydrazide
Smiles: O=C(NNC(=O)c1cccnc1)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK535021
Synonyms: 3- ({3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)benzoicacid
Smiles: O=C(Nc1cccc(c1)C(=O)O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK837667
Synonyms: 7- amino- 5- (2- chlorophenyl)- 2- methyl- 4- oxo- 3,5- dihydro- 4H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1Cl)c(=O)[nH]c(n2)C

STK837669
Synonyms: methyl4- [(Z)- {4- oxo- 3- [3- oxo- 3- (1,3- thiazol- 2- ylamino)propyl]- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)Nc1nccs1

STK535029
Synonyms: 2- cyano- N- cyclohexyl- 2- [3- (4- methylpiperidin- 1- yl)quinoxalin- 2- yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCC(CC1)C)C(=O)NC1CCCCC1

STK837671
Synonyms: N- tert- butyl- 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(NC(C)(C)C)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837672
Synonyms: methyl4- {[(4,6- dimethylpyrimidin- 2- yl)sulfanyl]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)CSc1nc(C)cc(n1)C

STK837673
Synonyms: 2,3- dihydro- 1- benzofuran- 2- yl(piperidin- 1- yl)methanone
Smiles: O=C(C1Cc2c(O1)cccc2)N1CCCCC1

STK535031
Synonyms: 2'- (4- fluorophenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc(cc1)F

STK837674
Synonyms: N- (4- ethoxyphenyl)- 3- [(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: CCOc1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\c2ccccc2F)/C1=O

STK837676
Synonyms: 1- (4- fluorophenyl)- 4- {[(E)- 2- phenylethenyl]sulfonyl}piperazine
Smiles: Fc1ccc(cc1)N1CCN(CC1)S(=O)(=O)/C=C/c1ccccc1

STK837677
Synonyms: N- (4- methyl- 1,3- thiazol- 2- yl)- 3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1scc(n1)C)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837678
Synonyms: (5E)- 3- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- thioxo- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazolidin- 4- one
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)c2c(C)n(n(c2=O)c2ccccc2)C)cc(c1OC)OC

STK535037
Synonyms: methylN- [{5- bromo- 2- [(phenylsulfonyl)amino]phenyl}(phenyl)methyl]glycinate
Smiles: COC(=O)CNC(c1cc(Br)ccc1NS(=O)(=O)c1ccccc1)c1ccccc1

STK535039
Synonyms: N- (4- bromophenyl)- 2- {[5- ethyl- 4- hydroxy- 1- (4- methylphenyl)- 6- oxo- 1,6- dihydropyrimidin- 2- yl]sulfanyl}acetamide
Smiles: CCc1c(O)nc(n(c1=O)c1ccc(cc1)C)SCC(=O)Nc1ccc(cc1)Br

STK535042
Synonyms: 2- [(1E)- 2- {[2- (3,4- dimethoxyphenyl)ethyl]amino}prop- 1- en- 1- yl]- 3- nitro- 1- benzofuran- 5- ol
Smiles: COc1cc(CCN/C(=C/c2oc3c(c2[N+](=O)[O-])cc(cc3)O)/C)ccc1OC

STK837683
Synonyms: morpholin- 4- yl[5- (thiophen- 2- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidin- 2- yl]methanone
Smiles: O=C(c1nn2c(c1)nc(cc2C(F)(F)F)c1cccs1)N1CCOCC1

STK837684
Synonyms: N- (3- bromophenyl)- 3- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1cccc(c1)Br)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK837685
Synonyms: 3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2,4- dichlorophenyl)propanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK837687
Synonyms: 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (2- nitrophenyl)butanamide
Smiles: O=C(Nc1ccccc1[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK535046
Synonyms: (3Z)- 1- acetyl- 5- bromo- 3- [3- (2- fluorophenyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: Brc1ccc2c(c1)/C(=C\1/SC(=S)N(C1=O)c1ccccc1F)/C(=O)N2C(=O)C

STK535048
Synonyms: (3E)- 3- {[(6- methylpyridin- 2- yl)amino]methylidene}- 1,3- dihydro- 2H- indol- 2- one
Smiles: Cc1cccc(n1)N/C=C\1/C(=O)Nc2c1cccc2

STK535056
Synonyms: N- (6- ethylthieno[2,3- d]pyrimidin- 4- yl)- L- leucine
Smiles: CCc1sc2c(c1)c(ncn2)N[C@H](C(=O)O)CC(C)C

STK837691
Synonyms: N- [(5Z)- 5- (2- nitrobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 2- phenylacetamide
Smiles: O=C(NN1C(=S)S/C(=C\c2ccccc2[N+](=O)[O-])/C1=O)Cc1ccccc1

STK837692
Synonyms: N- benzyl- N- tert- butyl- 4- [(5E)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(N(C(C)(C)C)Cc1ccccc1)CCCN1C(=S)S/C(=C/c2cccs2)/C1=O

STK535067
Synonyms: N- benzyl- 4- [(2E)- 2- (2,4- dimethoxybenzylidene)hydrazinyl]- 6- methylpyrimidin- 2- amine
Smiles: COc1cc(OC)ccc1/C=N/Nc1cc(C)nc(n1)NCc1ccccc1

STK837694
Synonyms: 2- (3- ethoxy- 4- hydroxyphenyl)- 3- phenyl- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: CCOc1cc(ccc1O)C1Nc2ccccc2C(=O)N1c1ccccc1

STK837699
Synonyms: 2- [(2Z)- 2- (2,2- dimethyl- 6- phenyl- 4H- 1,3- dioxin- 4- ylidene)ethylidene]- 1H- indene- 1,3(2H)- dione
Smiles: O=C1/C(=C/C=C\2/C=C(OC(O2)(C)C)c2ccccc2)/C(=O)c2c1cccc2

STK535075
Synonyms: 1,3- dimethyl- 8- [(3- phenylpropyl)sulfanyl]- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(SCCCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK837706
Synonyms: 4- [(7- chloro- 4- nitro- 2,1,3- benzoxadiazol- 5- yl)amino]phenol
Smiles: Oc1ccc(cc1)Nc1cc(Cl)c2c(c1[N+](=O)[O-])non2

STK837707
Synonyms: 3- amino- N- (4- ethylphenyl)- 4- (5- methylfuran- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1ccc(o1)C)c1c(n2)CCCC1

STK535086
Synonyms: N- (4- chlorophenyl)- 5- cyano- 2- methyl- 6- ({2- [(3- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)C

STK837712
Synonyms: 2- (2- bromo- 4- nitrophenyl)- 2,3- dihydro- 1H- naphtho[1,2- e][1,3]oxazine
Smiles: Brc1cc(ccc1N1COc2c(C1)c1ccccc1cc2)[N+](=O)[O-]

STK535096
Synonyms: 6- ({2- [(3- chlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)Cl)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK535104
Synonyms: 2,3- diphenylquinoline- 4- carboxylicacid
Smiles: OC(=O)c1c(c2ccccc2)c(nc2c1cccc2)c1ccccc1

STK837719
Synonyms: N- (4- ethoxyphenyl)- 3- methyl- 4- nitro- 1H- pyrazol- 5- amine
Smiles: CCOc1ccc(cc1)Nc1[nH]nc(c1[N+](=O)[O-])C

STK837721
Synonyms: 5- ethyl- 3,3- dimethyl- 6- (2- nitrophenyl)dihydro- 2H- pyran- 2,4(3H)- dione
Smiles: CCC1C(OC(=O)C(C1=O)(C)C)c1ccccc1[N+](=O)[O-]

STK837722
Synonyms: methyl2- {[(3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)acetyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)Cn2nc(c(c2C)[N+](=O)[O-])C)sc2c1CCCC2

STK535113
Synonyms: 2- hydroxy- 2,2- diphenyl- N'- (1- phenylethyl)acetohydrazide
Smiles: CC(c1ccccc1)NNC(=O)C(c1ccccc1)(c1ccccc1)O

STK837728
Synonyms: 7- benzyl- 3- methyl- 8- (4- phenylpiperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2Cc1ccccc1)N1CCN(CC1)c1ccccc1

STK535116
Synonyms: [2- (4- nitrophenyl)hydrazinylidene]propanedinitrile
Smiles: N#CC(=NNc1ccc(cc1)[N+](=O)[O-])C#N

STK535125
Synonyms: 6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- N- (2- methylphenyl)- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK837730
Synonyms: (2E)- 3- (1,3- benzodioxol- 5- yl)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\c1ccc2c(c1)OCO2)/c1scc(n1)c1cccc(c1)Br

STK535126
Synonyms: N'~1~,N'~2~- bis(5- bromopyridin- 2- yl)ethanedihydrazide
Smiles: Brc1ccc(nc1)NNC(=O)C(=O)NNc1ccc(cn1)Br

STK535128
Synonyms: methylhydrogen(3- hydrazinyl- 2- methyl- 3- oxopropyl)phosphonate
Smiles: NNC(=O)C(CP(=O)(OC)O)C

STK837732
Synonyms: 5- methyl- 2- [5- (2- nitrophenyl)- 1H- pyrazol- 3- yl]phenol
Smiles: Cc1ccc(c(c1)O)c1n[nH]c(c1)c1ccccc1[N+](=O)[O-]

STK535134
Synonyms: 6- ({2- [(5- chloro- 2- methoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- N- (2- methylphenyl)- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)ccc2OC)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1C)C

STK535135
Synonyms: bis(2- hydroxy- 3- {4- [(2Z)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}propyl)1,2,2- trimethylcyclopentane- 1,3- dicarboxylate
Smiles: OC(CN1CCN(CC1)C/C=C\c1ccccc1)COC(=O)C1CCC(C1(C)C)(C)C(=O)OCC(CN1CCN(CC1)C/C=C\c1ccccc1)O

STK535140
Synonyms: 5- cyano- 4- (furan- 2- yl)- 2- methyl- N- (2- methylphenyl)- 6- ({2- [(4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK535142
Synonyms: 2,3,3,3- tetrafluoro- 2- (heptafluoropropoxy)- N- (5- methyl- 1,2- oxazol- 3- yl)propanamide
Smiles: O=C(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)Nc1noc(c1)C

STK535145
Synonyms: 2- {[(2- bromophenyl)carbonyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylicacid
Smiles: Brc1ccccc1C(=O)Nc1sc2c(c1C(=O)O)CCCC2

STK837739
Synonyms: 6- nitro- 2- phenyl- 4H- 3,1- benzoxazin- 4- one
Smiles: [O-][N+](=O)c1ccc2c(c1)c(=O)oc(n2)c1ccccc1

STK535147
Synonyms: 4- amino- N'- hydroxy- N- (3- methylphenyl)- 1,2,5- oxadiazole- 3- carboximidamide
Smiles: O/N=C(/c1nonc1N)\Nc1cccc(c1)C

STK535155
Synonyms: (2Z)- 2- hydroxy- N'- [hydroxy(diphenyl)acetyl]- 4- (4- methylphenyl)- 4- oxobut- 2- enehydrazide
Smiles: Cc1ccc(cc1)C(=O)/C=C(/C(=O)NNC(=O)C(c1ccccc1)(c1ccccc1)O)\O

STK535157
Synonyms: 6- methyl- N- (4- methylphenyl)- 2- (morpholin- 4- yl)- 5- nitropyrimidin- 4- amine
Smiles: Cc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])C)N1CCOCC1

STK535162
Synonyms: 3- tert- butyl- N- (2- hydroxyethyl)- N,1- dimethyl- 4- nitro- 1H- pyrazole- 5- carboxamide
Smiles: OCCN(C(=O)c1n(C)nc(c1[N+](=O)[O-])C(C)(C)C)C

STK535176
Synonyms: 5- cyano- 2- methyl- 6- [(2- oxo- 2- {[4- (propan- 2- yl)phenyl]amino}ethyl)sulfanyl]- N,4- diphenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C(C)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK837751
Synonyms: 1,5- dimethyl- 4- {[(Z)- (3- methyl- 1- phenyl- 5- thioxo- 1,5- dihydro- 4H- pyrazol- 4- ylidene)methyl]amino}- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: CC1=NN(C(=S)/C/1=C\Nc1c(=O)n(n(c1C)C)c1ccccc1)c1ccccc1

STK535181
Synonyms: (2Z)- 4- oxo- 4- phenyl- 2- (phenylamino)but- 2- enoicacid
Smiles: OC(=O)/C(=C/C(=O)c1ccccc1)/Nc1ccccc1

STK535187
Synonyms: 1- (4- {[(E)- (2- hydroxy- 3- iodo- 6,7,8,9- tetrahydrodibenzo[b,d]furan- 1- yl)methylidene]amino}phenyl)ethanone
Smiles: Ic1cc2oc3c(c2c(c1O)/C=N/c1ccc(cc1)C(=O)C)CCCC3

STK837755
Synonyms: N- (2- chloro- 4- nitrophenyl)- 2- (3- nitro- 1H- 1,2,4- triazol- 1- yl)acetamide
Smiles: O=C(Nc1ccc(cc1Cl)[N+](=O)[O-])Cn1cnc(n1)[N+](=O)[O-]

STK837757
Synonyms: 2- amino- 6- (prop- 2- en- 1- ylsulfanyl)- 4- (thiophen- 2- yl)pyridine- 3,5- dicarbonitrile
Smiles: C=CCSc1nc(N)c(c(c1C#N)c1cccs1)C#N

STK837758
Synonyms: 4,7- diphenyl[1,2,5]oxadiazolo[3,4- d]pyridazine
Smiles: c1ccc(cc1)c1nnc(c2c1non2)c1ccccc1

STK837759
Synonyms: 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 4- (5- methylfuran- 2- yl)- 6- {[2- oxo- 2- (phenylamino)ethyl]sulfanyl}- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2)NC(=C(C1c1ccc(o1)C)C(=O)Nc1ccccc1OC)C

STK535194
Synonyms: N'- (3,5- di- tert- butyl- 4- oxocyclohexa- 2,5- dien- 1- ylidene)- 3- nitrobenzohydrazide
Smiles: O=C1C(=C/C(=N/NC(=O)c2cccc(c2)[N+](=O)[O-])/C=C1C(C)(C)C)C(C)(C)C

STK535195
Synonyms: 3- (1,3- benzodioxol- 5- ylmethyl)- 8- chloro- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccc2c(c1)OCO2

STK535196
Synonyms: N'- [(1E)- 1- (4- ethoxyphenyl)ethylidene]- 2- hydroxy- 2- propylpentanehydrazide
Smiles: CCCC(C(=O)N/N=C(/c1ccc(cc1)OCC)\C)(CCC)O

STK535202
Synonyms: 4- [4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]- 5H- pyrimido[5,4- b]indole
Smiles: COc1cccc(c1)N1CCN(CC1C)c1ncnc2c1[nH]c1c2cccc1

STK535206
Synonyms: (2Z)- 2- [(2- ammoniophenyl)amino]- 4- (4- methylphenyl)- 4- oxobut- 2- enoate
Smiles: Cc1ccc(cc1)C(=O)/C=C(/C(=O)[O-])\Nc1ccccc1[NH3+]

STK837766
Synonyms: 2- (5- methyl- 3,4- dinitro- 1H- pyrazol- 1- yl)- N- propylacetamide
Smiles: CCCNC(=O)Cn1nc(c(c1C)[N+](=O)[O-])[N+](=O)[O-]

STK535207
Synonyms: 2- [(4- benzylpiperazin- 1- yl)carbonyl]- 1- [(2- hydroxyethyl)amino]anthracene- 9,10- dione
Smiles: OCCNc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)N1CCN(CC1)Cc1ccccc1

STK837767
Synonyms: 2- (4- aminophenyl)- 1,3- benzoxazol- 6- amine
Smiles: Nc1ccc(cc1)c1oc2c(n1)ccc(c2)N

STK837768
Synonyms: 7- benzyl- 8- hydrazinyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: NNc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK535211
Synonyms: N- (4- fluorophenyl)- 2- (pyridin- 4- yl)quinazolin- 4- amine
Smiles: Fc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccncc1

STK535212
Synonyms: 3- {[(E)- (1- benzyl- 1H- indol- 3- yl)methylidene]amino}- 8- bromo- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Brc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1cn(c2c1cccc2)Cc1ccccc1

STK837776
Synonyms: 4- (4,6- diphenylpyridin- 2- yl)- N,N- dimethylaniline
Smiles: CN(c1ccc(cc1)c1cc(cc(n1)c1ccccc1)c1ccccc1)C

STK837778
Synonyms: 7- methylfuro[3,2- e][2,1,3]benzoxadiazole
Smiles: Cc1oc2c(c1)c1nonc1cc2

STK837779
Synonyms: ethyl2- ({[4- chloro- 5- methyl- 3- (trifluoromethyl)- 1H- pyrazol- 1- yl]acetyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)Cl)C(F)(F)F)sc2c1CCCC2

STK535230
Synonyms: 1- [5- fluoro- 4- oxo- 5- (trifluoromethyl)- 4,5- dihydro- 1,3- thiazol- 2- yl]- 3- naphthalen- 2- ylurea
Smiles: O=C(NC1=NC(=O)C(S1)(F)C(F)(F)F)Nc1ccc2c(c1)cccc2

STK837789
Synonyms: (2E)- 3- (1,3- benzodioxol- 5- ylamino)- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc2c(c1)OCO2)/C#N

STK837790
Synonyms: 2- amino- 4- cyclopropyl- 6- phenylcyclohexa- 1,3- diene- 1,3- dicarbonitrile
Smiles: N#CC1=C(N)C(=C(CC1c1ccccc1)C1CC1)C#N

STK837791
Synonyms: 5- cyano- 2- methyl- N- (2- methylphenyl)- 6- ({2- [(3- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1C)C

STK837793
Synonyms: 4- [4- (4- tert- butylphenoxy)- 6- methylpyrimidin- 2- yl]morpholine
Smiles: Cc1cc(Oc2ccc(cc2)C(C)(C)C)nc(n1)N1CCOCC1

STK837796
Synonyms: (4E)- N- {[(4- methylphenyl)sulfonyl]oxy}- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- imine
Smiles: Cc1ccc(cc1)S(=O)(=O)O/N=C/1\CCCc2c1non2

STK535251
Synonyms: 6- ({2- [(4- butoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: CCCCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1cccs1

STK535254
Synonyms: 2- (2,6- dimethoxyphenoxy)- N'- [(E)- phenylmethylidene]acetohydrazide
Smiles: COc1cccc(c1OCC(=O)N/N=C/c1ccccc1)OC

STK535255
Synonyms: ethyl5- methyl- 2- oxo- 4- phenylpyrrolidine- 3- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(C1c1ccccc1)C

STK535271
Synonyms: (2Z)- 4- (4- chlorophenyl)- 2- hydroxy- N'- [hydroxy(diphenyl)acetyl]- 4- oxobut- 2- enehydrazide
Smiles: Clc1ccc(cc1)C(=O)/C=C(/C(=O)NNC(=O)C(c1ccccc1)(c1ccccc1)O)\O

STK837807
Synonyms: (3- bromophenyl)[3- (2- hydroxyphenyl)- 1H- pyrazol- 4- yl]methanone
Smiles: Brc1cccc(c1)C(=O)c1c[nH]nc1c1ccccc1O

STK837809
Synonyms: N- cyclopentyl- 5,7- diphenylpyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(c1)nc(cc2c1ccccc1)c1ccccc1)NC1CCCC1

STK535272
Synonyms: (4Z)- 4- (2,3- dimethoxybenzylidene)- 2- (furan- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: COc1c(cccc1OC)/C=C/1\N=C(OC1=O)c1ccco1

STK837813
Synonyms: 8- {(2E)- 2- [(2Z)- 2- bromo- 3- phenylprop- 2- en- 1- ylidene]hydrazinyl}- 1,3- dimethyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(N/N=C/C(=C/c2ccccc2)/Br)nc2c1c(=O)n(c(=O)n2C)C

STK535278
Synonyms: 2- hydroxy- 2,2- bis(4- methylphenyl)- N'- [(1E)- 1- phenylbutylidene]acetohydrazide
Smiles: CCC/C(=N\NC(=O)C(c1ccc(cc1)C)(c1ccc(cc1)C)O)/c1ccccc1

STK535284
Synonyms: 4- amino- 3- (4- chlorophenyl)butanoicacid
Smiles: NCC(c1ccc(cc1)Cl)CC(=O)O

STK535285
Synonyms: 5,5'- [sulfonylbis(benzene- 4,1- diylcarbonylimino)]dibenzene- 1,3- dicarboxylicacid
Smiles: O=C(c1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1cc(cc(c1)C(=O)O)C(=O)O)Nc1cc(cc(c1)C(=O)O)C(=O)O

STK535288
Synonyms: 2- chloro- 3- (4- methylpiperidin- 1- yl)naphthalene- 1,4- dione
Smiles: CC1CCN(CC1)C1=C(Cl)C(=O)c2c(C1=O)cccc2

STK535291
Synonyms: 6- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 5- cyano- 4- (furan- 2- yl)- 2- methyl- N- (2- methylphenyl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)Br)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK837819
Synonyms: ethyl(5Z)- 5- {[1- (3- chlorophenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 2- methyl- 4- oxo- 4,5- dihydro- 1H- pyrrole- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)N/C(=C\c2cc(n(c2C)c2cccc(c2)Cl)C)/C1=O

STK837821
Synonyms: 6- (azepan- 1- yl)- 2- (3,5- dimethyl- 1H- pyrazol- 4- yl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Cc1n[nH]c(c1n1c(=O)c2ccc(c3c2c(c1=O)ccc3)N1CCCCCC1)C

STK535295
Synonyms: 2- (4- benzylpiperidin- 1- yl)- 1- (8- methyl- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)ethanone
Smiles: Cc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCC(CC1)Cc1ccccc1

STK837823
Synonyms: 2- (4- fluorophenyl)- 5- (4- methoxyphenyl)- 4H- thieno[2,3- d][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1csc2c1c(=O)oc(n2)c1ccc(cc1)F

STK837827
Synonyms: 5- chloro- N- (4- iodophenyl)- 3- methyl- 1- phenyl- 1H- pyrazole- 4- carboxamide
Smiles: Ic1ccc(cc1)NC(=O)c1c(C)nn(c1Cl)c1ccccc1

STK535296
Synonyms: 4- amino- 2- [(2- {[4- (dimethylamino)phenyl]amino}- 2- oxoethyl)sulfanyl]- N- (4- methoxyphenyl)- 1,3- thiazole- 5- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1sc(nc1N)SCC(=O)Nc1ccc(cc1)N(C)C

STK535298
Synonyms: 5- cyano- 2- methyl- 6- {[2- (naphthalen- 1- ylamino)- 2- oxoethyl]sulfanyl}- N,4- diphenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc3c2cccc3)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK535302
Synonyms: 3- amino- N- (2- ethylphenyl)- 4- (5- methylfuran- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCc1ccccc1NC(=O)c1sc2c(c1N)c(c1ccc(o1)C)c1c(n2)CCCC1

STK837829
Synonyms: 4- amino- N- [4- (dimethylamino)phenyl]- 2- [(2- {[4- (dimethylamino)phenyl]amino}- 2- oxoethyl)sulfanyl]- 1,3- thiazole- 5- carboxamide
Smiles: O=C(Nc1ccc(cc1)N(C)C)CSc1sc(c(n1)N)C(=O)Nc1ccc(cc1)N(C)C

STK837832
Synonyms: ethyl2- {[(4- bromo- 5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetyl]amino}- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)Br)[N+](=O)[O-])sc2c1CCC2

STK535314
Synonyms: 2- (4- chloro- 3- nitrophenyl)- 2- oxoethylpyrazine- 2- carboxylate
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])Cl)COC(=O)c1cnccn1

STK535317
Synonyms: 8- [(2E)- 2- (4- methoxybenzylidene)hydrazinyl]- 1,3- dimethyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(N/N=C/c2ccc(cc2)OC)nc2c1c(=O)n(c(=O)n2C)C

STK535322
Synonyms: 1- methyl- 3- [2- (naphthalen- 2- yloxy)ethyl]- 1,3- dihydro- 2H- benzimidazol- 2- imine
Smiles: Cn1c(=N)n(c2c1cccc2)CCOc1ccc2c(c1)cccc2

STK535324
Synonyms: N- (1H- benzotriazol- 1- ylmethyl)- 4- phenyl- 1,2,5- oxadiazol- 3- amine
Smiles: c1ccc(cc1)c1nonc1NCn1nnc2c1cccc2

STK535327
Synonyms: (2Z)- 2- [(2- ammoniophenyl)amino]- 4- (4- chlorophenyl)- 4- oxobut- 2- enoate
Smiles: Clc1ccc(cc1)C(=O)/C=C(/C(=O)[O-])\Nc1ccccc1[NH3+]

STL036487
Synonyms: methyl(5E)- 5- (furan- 2- ylmethylidene)- 2- methyl- 4- oxo- 1- phenyl- 4,5- dihydro- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)C1=C(C)N(/C(=C/c2ccco2)/C1=O)c1ccccc1

STK535331
Synonyms: 2- {[(3- chlorophenyl)carbonyl]amino}- 4- (4- methoxyphenyl)thiophene- 3- carboxylicacid
Smiles: COc1ccc(cc1)c1csc(c1C(=O)O)NC(=O)c1cccc(c1)Cl

STK535334
Synonyms: 5- methyl- 2- phenyl- 8- (propan- 2- yl)- 1,2,5,6,7,8- hexahydroquinoline- 3,3,4,4- tetracarbonitrile
Smiles: N#CC1(C#N)C2=C(NC(C1(C#N)C#N)c1ccccc1)C(CCC2C)C(C)C

STK837848
Synonyms: 2- (2,4- dichlorophenyl)- N- [(E)- (5- methylfuran- 2- yl)methylidene]- 1H- benzimidazol- 5- amine
Smiles: Clc1ccc(c(c1)Cl)c1[nH]c2c(n1)cc(cc2)/N=C/c1ccc(o1)C

STK535345
Synonyms: (4Z,5E)- 3- tert- butyl- N,N'- dihydroxy- 1,2- oxazole- 4,5- diimine
Smiles: O/N=C/1\C(=N/O)\ON=C1C(C)(C)C

STK535348
Synonyms: 3- (3- tert- butyl- 1- methyl- 7- oxo- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)- 4- ethoxy- N- (4- methylphenyl)benzenesulfonamide
Smiles: CCOc1ccc(cc1c1nc2c(c(=O)[nH]1)n(nc2C(C)(C)C)C)S(=O)(=O)Nc1ccc(cc1)C

STK535349
Synonyms: 2- (2,4- dichlorophenyl)- 9- phenyltetrahydro- 5H- pyrazolo[1,2- a]pyrrolo[3,4- c]pyrazole- 1,3(2H,3aH)- dione
Smiles: Clc1ccc(c(c1)Cl)N1C(=O)C2C(C1=O)N1N(C2c2ccccc2)CCC1

STK535351
Synonyms: 8- bromo- 1,3- dimethyl- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(=C)Cn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

STK837857
Synonyms: 5- (4- bromophenyl)- N- [2- (methylsulfanyl)phenyl]- 7- (trifluoromethyl)- 4,5,6,7- tetrahydropyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CSc1ccccc1NC(=O)c1nn2c(c1)NC(CC2C(F)(F)F)c1ccc(cc1)Br

STK535357
Synonyms: (3E)- 3- [2- (1H- tetrazol- 5- yl)hydrazinylidene]- 1- azabicyclo[2.2.2]octane
Smiles: n1nnc([nH]1)N/N=C\1/CN2CCC1CC2

STK535358
Synonyms: methyl5- bromo- 3- {[(6- fluoro- 2- methyl- 3,4- dihydroquinolin- 1(2H)- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1C(C)CCc3c1ccc(c3)F)cc(cc2)Br

STK535359
Synonyms: (2Z)- 2- [(15E)- 15- (2- carbamoylhydrazinylidene)henicosan- 7- ylidene]hydrazinecarboxamide
Smiles: CCCCCC/C(=N/NC(=O)N)/CCCCCCC/C(=N/NC(=O)N)/CCCCCC

STK535361
Synonyms: N- {4- [(2E)- 3- (1,3- benzodioxol- 5- yl)prop- 2- enoyl]phenyl}- 4- tert- butylbenzamide
Smiles: O=C(c1ccc(cc1)NC(=O)c1ccc(cc1)C(C)(C)C)/C=C/c1ccc2c(c1)OCO2

STK837866
Synonyms: 5,7- dimethyl- N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene][1,2,4]triazolo[1,5- a]pyrimidine- 2- carbohydrazide
Smiles: Cc1cc(C)n2c(n1)nc(n2)C(=O)N/N=C/C=C/c1ccccc1

STK535368
Synonyms: 1'- (3,5- dichlorophenyl)- 2'H,5'H- spiro[bicyclo[2.2.1]hept- 5- ene- 2,3'- pyrrolidine]- 2',5'- dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)CC2(C1=O)CC1CC2C=C1

STK837870
Synonyms: (2E)- 3- [(4- fluorophenyl)amino]- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: CC(Cc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)F)/C#N)C

STK535371
Synonyms: 8- (hexylsulfanyl)- 1,3- dimethyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(SCCCCCC)nc2c1c(=O)n(c(=O)n2C)C

STK535373
Synonyms: 3'- (3- methylphenyl)- 2'H- spiro[indole- 3,4'- [1,3]thiazolidine]- 2,2'(1H)- dione
Smiles: Cc1cccc(c1)N1C(=O)SCC21C(=O)Nc1c2cccc1

STK837875
Synonyms: (4Z)- 4- [(1- acetyl- 1H- indol- 3- yl)methylidene]- 2- (2- fluorophenyl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1cn(c2c1cccc2)C(=O)C)c1ccccc1F

STK535379
Synonyms: 3- {[4- (6- methyl- 1,3- benzothiazol- 2- yl)phenyl]amino}- 3- phenyl- 2- benzofuran- 1(3H)- one
Smiles: Cc1ccc2c(c1)sc(n2)c1ccc(cc1)NC1(OC(=O)c2c1cccc2)c1ccccc1

STK535382
Synonyms: 3- (4- chlorophenyl)- 5- (1,3- dioxolan- 2- yl)- 2,1- benzoxazole
Smiles: Clc1ccc(cc1)c1onc2c1cc(cc2)C1OCCO1

STK535384
Synonyms: 2- (4- bromophenyl)- 4- (piperazin- 1- yl)quinazoline
Smiles: Brc1ccc(cc1)c1nc(N2CCNCC2)c2c(n1)cccc2

STK535392
Synonyms: 3- chloro- 4- (diethylamino)- 1- {6- oxo- 6- [(tributylstannanyl)oxy]hexyl}- 1H- pyrrole- 2,5- dione
Smiles: CCCC[Sn](OC(=O)CCCCCN1C(=O)C(=C(C1=O)N(CC)CC)Cl)(CCCC)CCCC

STK837883
Synonyms: 1- methyl- N- {2- methyl- 4- [(E)- (2- methylphenyl)diazenyl]phenyl}- 1H- pyrazole- 5- carboxamide
Smiles: Cc1cc(ccc1NC(=O)c1ccnn1C)/N=N/c1ccccc1C

STK837885
Synonyms: 5- nitrospiro[benzimidazole- 2,1'- cyclohexane]1,3- dioxide
Smiles: [O-][N+](=O)c1ccc2=[N+](C3([N+](=c2c1)[O-])CCCCC3)[O-]

STK837887
Synonyms: benzyl3- amino- 4- (5- methylfuran- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxylate
Smiles: Cc1ccc(o1)c1c2CCCCc2nc2c1c(N)c(s2)C(=O)OCc1ccccc1

STK535396
Synonyms: 3- bromo- 5- {[4- (4- fluorophenyl)piperazin- 1- yl]carbonyl}- 2H- pyran- 2- one
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)c1coc(=O)c(c1)Br

STK837889
Synonyms: 6- amino- 2- (3,5- dimethyl- 1H- pyrazol- 4- yl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Cc1n[nH]c(c1n1c(=O)c2cccc3c2c(c1=O)ccc3N)C

STK535400
Synonyms: methyl3'- methyl- 5'- oxo- 1'- phenyl- 3- (trifluoromethyl)- 1',5'- dihydrospiro[bicyclo[2.2.1]hept- 5- ene- 2,4'- pyrazole]- 3- carboxylate
Smiles: COC(=O)C1(C2C=CC(C31C(=NN(C3=O)c1ccccc1)C)C2)C(F)(F)F

STK837892
Synonyms: N- (furan- 2- ylmethyl)- 3- methyl- 1- phenyl- 1H- thieno[2,3- c]pyrazole- 5- carboxamide
Smiles: O=C(c1cc2c(s1)n(nc2C)c1ccccc1)NCc1ccco1

STK837897
Synonyms: ethyl5- phenyl- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 3- carboxylate
Smiles: CCOC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccccc1

STK837898
Synonyms: N- (4- bromophenyl)- 2- {[4- (3- chlorophenyl)- 3- cyano- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)NC(=O)CC1c1cccc(c1)Cl

STK535411
Synonyms: 4- {[2- (pyridin- 4- yl)quinazolin- 4- yl]oxy}benzonitrile
Smiles: N#Cc1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccncc1

STK837903
Synonyms: 7- hydroxy- 5- oxo- N- (pyridin- 3- ylmethyl)- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: O=C(c1c(O)c2cccc3c2n(c1=O)CCC3)NCc1cccnc1

STK837904
Synonyms: N- (2- hydroxyphenyl)- 2- (4- methoxyphenyl)quinoline- 4- carboxamide
Smiles: COc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Nc1ccccc1O

STK535414
Synonyms: methyl(2Z)- 3- [(4- chlorophenyl)carbonyl]- 5- (dibenzylamino)- 4,5- dioxo- 2- (phenylamino)pent- 2- enoate
Smiles: COC(=O)/C(=C(\C(=O)c1ccc(cc1)Cl)/C(=O)C(=O)N(Cc1ccccc1)Cc1ccccc1)/Nc1ccccc1

STK837905
Synonyms: [3- amino- 4- (5- methylfuran- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinolin- 2- yl](3- bromophenyl)methanone
Smiles: Brc1cccc(c1)C(=O)c1sc2c(c1N)c(c1ccc(o1)C)c1c(n2)CCCC1

STK837907
Synonyms: 2- {[(3- nitro- 1H- 1,2,4- triazol- 1- yl)acetyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCCC2)Cn1cnc(n1)[N+](=O)[O-]

STK535425
Synonyms: 4,4'- (1- methyl- 1H- 1,2,4- triazole- 3,5- diyl)bis(1,2,5- oxadiazol- 3- amine)
Smiles: Nc1nonc1c1nc(n(n1)C)c1nonc1N

STK837912
Synonyms: N- phenyl- 2- [(1E)- 2,2,2- trifluoro- N- (4- methoxyphenyl)ethanimidoyl]hydrazinecarboxamide
Smiles: COc1ccc(cc1)/N=C(\C(F)(F)F)/NNC(=O)Nc1ccccc1

STK837913
Synonyms: ethyl(2E)- 3- [5- (4- fluorophenyl)- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]but- 2- enoate
Smiles: CCOC(=O)/C=C(/N1N=C(CC1c1ccc(cc1)F)c1cccs1)\C

STK837917
Synonyms: 2- [4- bromo- 5- methyl- 3- (trifluoromethyl)- 1H- pyrazol- 1- yl]- N- (3- cyano- 6- methyl- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)acetamide
Smiles: N#Cc1c(NC(=O)Cn2nc(c(c2C)Br)C(F)(F)F)sc2c1CCC(C2)C

STK535431
Synonyms: N'- [(E)- (3- bromo- 2- hydroxy- 6,7,8,9- tetrahydrodibenzo[b,d]furan- 1- yl)methylidene]furan- 2- carbohydrazide
Smiles: Brc1cc2oc3c(c2c(c1O)/C=N/NC(=O)c1ccco1)CCCC3

STK535432
Synonyms: ethyl5- cyano- 6- [(cyanomethyl)sulfanyl]- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC#N

STK535439
Synonyms: 5- cyano- 6- ({2- [(4- methoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- (2- methylphenyl)- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)OC)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK837920
Synonyms: 5,5- dimethyl- 3- (pyridin- 4- yl)- 5,6- dihydro[1,2,4]triazolo[3,4- a]isoquinoline
Smiles: CC1(C)Cc2ccccc2c2n1c(nn2)c1ccncc1

STK535440
Synonyms: N- {1,1,1,3,3,3- hexafluoro- 2- [(4- methyl- 1,3- thiazol- 2- yl)amino]propan- 2- yl}- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1scc(n1)C

STK837922
Synonyms: 3- amino- 4- (5- methylfuran- 2- yl)- N- (3- methylphenyl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1sc2c(c1N)c(c1ccc(o1)C)c1c(n2)CCCC1

STK535442
Synonyms: 2- ({(E)- 2- cyano- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzamide
Smiles: N#C/C(=C\Nc1ccccc1C(=O)N)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK837925
Synonyms: 3- amino- N- (4- butoxyphenyl)- 4- (5- methylfuran- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCCCOc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1ccc(o1)C)c1c(n2)CCCC1

STK535448
Synonyms: 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- N- (2- methoxyphenyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK535449
Synonyms: 5- (2- chlorophenyl)- 3- methyl[1,2,4]triazolo[4,3- c]quinazoline
Smiles: Clc1ccccc1c1nc2ccccc2c2n1c(C)nn2

STK837927
Synonyms: 2- {[3- cyano- 6- oxo- 4- (thiophen- 2- yl)- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)NC(=O)CC1c1cccs1

STK535451
Synonyms: N'- [(2- bromo- 1- methylcyclopropyl)carbonyl]- 2- oxo- 2H- pyran- 5- carbohydrazide
Smiles: O=c1ccc(co1)C(=O)NNC(=O)C1(C)CC1Br

STK535459
Synonyms: 3- amino- 2- benzyl- 7- nitro- 1- oxo- 1,2- dihydroisoquinoline- 4- carbonitrile
Smiles: N#Cc1c(N)n(Cc2ccccc2)c(=O)c2c1ccc(c2)[N+](=O)[O-]

STK535460
Synonyms: 7- (methylsulfanyl)- 4- oxo- 1,4- dihydro[1,2,4]triazolo[5,1- c][1,2,4]triazine- 3- carboxylicacid
Smiles: CSc1nn2c(n1)[nH]nc(c2=O)C(=O)O

STK535461
Synonyms: 8- fluoro- 4- [4- (2- methoxyphenyl)piperazin- 1- yl]- 5H- pyrimido[5,4- b]indole
Smiles: COc1ccccc1N1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)F

STK535462
Synonyms:
Smiles: NC1=C(c2ccccc2)P(=O)([C@H]2[C@@H]1[C@@H]1C[C@@H](C1(C)C)C2)Cc1ccccc1

STK535463
Synonyms: N'- [(E)- (5- bromo- 2,4- dimethoxyphenyl)methylidene]- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- carbohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1nn2c(n1)nc(cc2C)C)Br

STK837930
Synonyms: 2,6- di- tert- butylhexahydro- 1H,5H- 2,3a,4a,6,7a,8a- hexaazacyclopenta[def]fluorene- 4,8- dione
Smiles: CC(N1CN2C(=O)N3C4C2N(C1)C(=O)N4CN(C3)C(C)(C)C)(C)C

STK535465
Synonyms: butyl2,3- dioxo- 2,3- dihydro- 1H- indole- 1- carboxylate
Smiles: CCCCOC(=O)N1c2ccccc2C(=O)C1=O

STK535467
Synonyms: 4,6- dihydroxy- 1- [(4- methoxyphenyl)carbonyl]- 5,6- diphenyl- 1,6- dihydropyridazin- 3(2H)- one
Smiles: COc1ccc(cc1)C(=O)N1NC(=O)C(=C(C1(O)c1ccccc1)c1ccccc1)O

STK837938
Synonyms: (4Z)- 4- (2,3- dimethoxybenzylidene)- 2- (4- fluorophenyl)- 1,3- oxazol- 5(4H)- one
Smiles: COc1cccc(c1OC)/C=C/1\N=C(OC1=O)c1ccc(cc1)F

STK535474
Synonyms: [4- (8- bromo- 5H- pyrimido[5,4- b]indol- 4- yl)piperazin- 1- yl](furan- 2- yl)methanone
Smiles: Brc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)C(=O)c1ccco1

STK837940
Synonyms: [5- hydroxy- 1- (4- methoxyphenyl)- 2- methyl- 1H- indol- 3- yl](phenyl)methanone
Smiles: COc1ccc(cc1)n1c2ccc(cc2c(c1C)C(=O)c1ccccc1)O

STK837944
Synonyms: ethyl[(2Z)- 2- (1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl](oxo)acetate
Smiles: CCOC(=O)C(=O)N/N=C/1\C(=O)N(c2c1cccc2)CC

STK535500
Synonyms: 5- methoxy- 2- methyl- 1- (2- methylpropyl)- 1H- indole- 3- carboxylicacid
Smiles: COc1ccc2c(c1)c(C(=O)O)c(n2CC(C)C)C

STK535507
Synonyms: 2- {[(2- fluorophenyl)carbonyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylicacid
Smiles: Fc1ccccc1C(=O)Nc1sc2c(c1C(=O)O)CCCC2

STK837952
Synonyms: 8- (butylamino)- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCNc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

STK837953
Synonyms: 3- acetyl- 2- methylnaphtho[1,2- b]furan- 5- ylfuran- 2- carboxylate
Smiles: CC(=O)c1c(C)oc2c1cc(OC(=O)c1ccco1)c1c2cccc1

STK535512
Synonyms: 4- (benzyloxy)- 2- (pyridin- 4- yl)quinazoline
Smiles: c1ccc(cc1)COc1nc(nc2c1cccc2)c1ccncc1

STK535513
Synonyms: 5- cyano- 4- (furan- 2- yl)- N- (2- methoxyphenyl)- 2- methyl- 6- {[2- (naphthalen- 2- ylamino)- 2- oxoethyl]sulfanyl}- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc3c(c2)cccc3)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK535514
Synonyms: N- (pentacyclo[7.3.1.1~4,12~.0~2,7~.0~6,11~]tetradec- 1- yl)acetamide(non- preferredname)
Smiles: CC(=O)NC12CC3CC4C2CC2CC1C(C3)C4C2

STK535522
Synonyms: 5- cyano- 2- methyl- N- (2- methylphenyl)- 6- [(2- oxo- 2- {[4- (propan- 2- yl)phenyl]amino}ethyl)sulfanyl]- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C(C)C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK535527
Synonyms: 2- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]- 1- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)c(n2C)C

STK837959
Synonyms: 1- [(E)- (pyridin- 2- ylimino)methyl]naphthalen- 2- ol
Smiles: Oc1ccc2c(c1/C=N/c1ccccn1)cccc2

STK837960
Synonyms: 5- cyano- 2- methyl- N,4- diphenyl- 6- thioxo- 1,6- dihydropyridine- 3- carboxamide
Smiles: N#Cc1c(=S)[nH]c(c(c1c1ccccc1)C(=O)Nc1ccccc1)C

STK535529
Synonyms: 1- (8- fluoro- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}ethanone
Smiles: Fc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F

STK837961
Synonyms: (4Z)- 4- [(1- acetyl- 1H- indol- 3- yl)methylidene]- 2- (4- tert- butylphenyl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1cn(c2c1cccc2)C(=O)C)c1ccc(cc1)C(C)(C)C

STK535531
Synonyms: N'- [(E)- (3- chlorophenyl)methylidene]- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- carbohydrazide
Smiles: Clc1cccc(c1)/C=N/NC(=O)c1nn2c(n1)nc(cc2C)C

STK535536
Synonyms: ethyl2- (acetylamino)- N- [5- (3- ethoxy- 1,1,1- trifluoro- 2- hydroxy- 3- oxopropan- 2- yl)- 2- methoxyphenyl]- 3,3,3- trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1cc(ccc1OC)C(C(F)(F)F)(C(=O)OCC)O)NC(=O)C

STK535539
Synonyms: 6- phenyl- 2- [(E)- 2- phenylethenyl]pyrimidin- 4(3H)- one
Smiles: O=c1[nH]c(/C=C/c2ccccc2)nc(c1)c1ccccc1

STK837968
Synonyms: (4Z)- 4- (2,5- dimethoxybenzylidene)- 2- (thiophen- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: COc1ccc(cc1/C=C/1\N=C(OC1=O)c1cccs1)OC

STK535542
Synonyms: bis[2- (4- chloro- 3- nitrophenyl)- 2- oxoethyl]2,2'- (1,3,5,7- tetraoxo- 5,7- dihydropyrrolo[3,4- f]isoindole- 2,6(1H,3H)- diyl)diacetate
Smiles: O=C(Cn1c(=O)c2c(c1=O)cc1c(c2)c(=O)n(c1=O)CC(=O)OCC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)OCC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK535544
Synonyms: (2E)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- (1H- indazol- 6- ylamino)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)[nH]nc2)/c1scc(n1)c1ccc(cc1)Cl

STK837969
Synonyms: N- [(1Z)- 3- {[2- (1H- indol- 3- yl)ethyl]amino}- 3- oxo- 1- (pyridin- 3- yl)prop- 1- en- 2- yl]furan- 2- carboxamide
Smiles: O=C(/C(=C/c1cccnc1)/NC(=O)c1ccco1)NCCc1c[nH]c2c1cccc2

STK837970
Synonyms: 2- chloro- 6- methoxy- 4- {(Z)- [5- oxo- 2- (thiophen- 2- yl)- 1,3- oxazol- 4(5H)- ylidene]methyl}phenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2cccs2)cc(c1OC(=O)C)Cl

STK535556
Synonyms: N- {1,1,1,3,3,3- hexafluoro- 2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)amino]propan- 2- yl}- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1nnc(s1)C

STK535558
Synonyms: N- (2- {[5- (ethylsulfanyl)- 1,3,4- thiadiazol- 2- yl]amino}- 1,1,1,3,3,3- hexafluoropropan- 2- yl)furan- 2- carboxamide
Smiles: CCSc1nnc(s1)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccco1

STK837979
Synonyms: 5- nitro- 2- (pyridin- 2- ylamino)cyclohepta- 2,4,6- trien- 1- one
Smiles: O=c1ccc(ccc1Nc1ccccn1)[N+](=O)[O-]

STK837980
Synonyms: N,N- diethyl- 2- (pyridin- 4- yl)quinazolin- 4- amine
Smiles: CCN(c1nc(nc2c1cccc2)c1ccncc1)CC

STK535561
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 1- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)propan- 1- one
Smiles: COc1ccc2c(c1)c(C(=O)C(N1CCN(CC1)Cc1ccc3c(c1)OCO3)C)c(n2C)C

STK535563
Synonyms: 3- (9- methyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)naphthalen- 2- ol
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1cc2ccccc2cc1O

STK837987
Synonyms: N- (2,6- dimethylphenyl)- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Cc1cccc(c1NC(=O)c1c(=O)[nH]c2c(c1O)cccc2)C

STK535573
Synonyms: 3- (2,6- dimethylmorpholin- 4- yl)- 5- (phenylamino)- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: CC1OC(C)CN(C1)c1cc(Nc2ccccc2)c2c3c1noc3c1c(C2=O)cccc1

STK535583
Synonyms: 1- (1H- indol- 3- yl)- 2- [4- (2- methoxyphenyl)piperazin- 1- yl]propan- 1- one
Smiles: COc1ccccc1N1CCN(CC1)C(C(=O)c1c[nH]c2c1cccc2)C

STK535593
Synonyms: N- [3- (dimethylamino)propyl]- N'- (5- propyl- 1,3,4- thiadiazol- 2- yl)ethanediamide
Smiles: CCCc1nnc(s1)NC(=O)C(=O)NCCCN(C)C

STK535598
Synonyms: 2- chloro- 3- (2,6- dimethylmorpholin- 4- yl)naphthalene- 1,4- dione
Smiles: CC1OC(C)CN(C1)C1=C(Cl)C(=O)c2c(C1=O)cccc2

STK535600
Synonyms: tert- butyl6- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 4- (4- chlorophenyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)Br)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK838009
Synonyms: N- (3- bromophenyl)- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Brc1cccc(c1)NC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK535603
Synonyms: 2- (4- bromophenyl)- 4- (3,5- dimethyl- 1H- pyrazol- 1- yl)quinazoline
Smiles: Brc1ccc(cc1)c1nc2ccccc2c(n1)n1nc(cc1C)C

STK535605
Synonyms: 4- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 8- methoxy- 5H- pyrimido[5,4- b]indole
Smiles: COc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK838010
Synonyms: butyl6- [(4- fluorophenyl)sulfamoyl]- 2- oxo- 1,3- benzoxazole- 3(2H)- carboxylate
Smiles: CCCCOC(=O)n1c(=O)oc2c1ccc(c2)S(=O)(=O)Nc1ccc(cc1)F

STK535606
Synonyms: N'- (3- bromophenyl)- 2- hydroxy- 2,2- diphenylacetohydrazide
Smiles: Brc1cccc(c1)NNC(=O)C(c1ccccc1)(c1ccccc1)O

STK838013
Synonyms: butyl{[6- amino- 3,5- dicyano- 4- (4- methoxyphenyl)pyridin- 2- yl]sulfanyl}acetate
Smiles: CCCCOC(=O)CSc1nc(N)c(c(c1C#N)c1ccc(cc1)OC)C#N

STK535614
Synonyms: 4- {4- [(2E)- 2- (2,4- dimethoxybenzylidene)hydrazinyl]- 6- methylpyrimidin- 2- yl}morpholine
Smiles: COc1cc(OC)ccc1/C=N/Nc1cc(C)nc(n1)N1CCOCC1

STK535616
Synonyms: N'- (chloroacetyl)- 2- hydroxy- N',2,2- triphenylacetohydrazide
Smiles: ClCC(=O)N(c1ccccc1)NC(=O)C(c1ccccc1)(c1ccccc1)O

STK535621
Synonyms: 2- {[(E)- furan- 2- ylmethylidene]amino}- 6- methyl- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxamide
Smiles: CN1CCc2c(C1)sc(c2C(=O)N)/N=C/c1ccco1

STK838015
Synonyms: 5- (4- bromophenyl)- N- (4- chlorophenyl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc2n(n1)c(cc(n2)c1ccc(cc1)Br)C(F)(F)F

STK838016
Synonyms: 2- [(3- cyano- 6- oxo- 4- phenyl- 1,4,5,6- tetrahydropyridin- 2- yl)sulfanyl]- N- (4- ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1

STK535634
Synonyms: (4Z)- 4- [4- (benzyloxy)benzylidene]- 2- (thiophen- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1ccc(cc1)OCc1ccccc1)c1cccs1

STK838018
Synonyms: N- tert- butyl- 3- (3- tert- butyl- 1- methyl- 7- oxo- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)- 4- ethoxybenzenesulfonamide
Smiles: CCOc1ccc(cc1c1[nH]c(=O)c2c(n1)c(nn2C)C(C)(C)C)S(=O)(=O)NC(C)(C)C

STK535640
Synonyms: 8- bromo- 7- [(2E)- but- 2- en- 1- yl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

STK535641
Synonyms: 5- cyano- 6- ({2- [(2,5- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- N- (2- methoxyphenyl)- 2- methyl- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK838021
Synonyms: (4Z)- 2- (3- methylphenyl)- 4- (2,3,4- trimethoxybenzylidene)- 1,3- oxazol- 5(4H)- one
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\N=C(OC1=O)c1cccc(c1)C

STK838022
Synonyms: [3- amino- 4- (5- methylfuran- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinolin- 2- yl](4- methylphenyl)methanone
Smiles: Cc1ccc(cc1)C(=O)c1sc2c(c1N)c(c1ccc(o1)C)c1c(n2)CCCC1

STK535650
Synonyms: 5- phenyl- 3- (phenylamino)furan- 2(5H)- one
Smiles: O=C1OC(C=C1Nc1ccccc1)c1ccccc1

STK535651
Synonyms: methyl3- {[2- (2,6- dimethylmorpholin- 4- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CC(C)OC(C1)C)C)cccc2

STK535656
Synonyms: 2,6- diamino- 4- (1- phenylethyl)- 4H- pyran- 3,5- dicarbonitrile
Smiles: CC(C1C(=C(N)OC(=C1C#N)N)C#N)c1ccccc1

STK838028
Synonyms: (4Z)- 2- (naphthalen- 1- yl)- 4- [4- (propan- 2- yl)benzylidene]- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1ccc(cc1)C(C)C)c1cccc2c1cccc2

STK535661
Synonyms: N'- [(E)- (2,4- dimethoxyphenyl)methylidene]- 3,4,5- trihydroxybenzohydrazide
Smiles: COc1ccc(c(c1)OC)/C=N/NC(=O)c1cc(O)c(c(c1)O)O

STK535663
Synonyms: 3- (quinoxalin- 2- yl)phenyl2- (4- methylphenyl)quinoline- 4- carboxylate
Smiles: Cc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Oc1cccc(c1)c1cnc2c(n1)cccc2

STK838034
Synonyms: 2- ethyl- N'- [(3Z)- 1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- 2- hydroxybutanehydrazide
Smiles: CCN1c2ccccc2/C(=N/NC(=O)C(CC)(CC)O)/C1=O

STK535670
Synonyms: N- carbamimidoyl- 4- {[(E)- (4- methoxyphenyl)methylidene]amino}benzenesulfonamide
Smiles: COc1ccc(cc1)/C=N/c1ccc(cc1)S(=O)(=O)NC(=N)N

STK838042
Synonyms: 3- bromo- N- (cyanomethyl)- 5- phenyl- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: N#CCNC(=O)c1nn2c(c1Br)nc(cc2C(F)(F)F)c1ccccc1

STK535677
Synonyms: 2,2- bis(2,5- dimethylphenyl)- 2- hydroxy- N'- [(1Z)- 1- phenylbutylidene]acetohydrazide
Smiles: CCC/C(=N/NC(=O)C(c1cc(C)ccc1C)(c1cc(C)ccc1C)O)/c1ccccc1

STK535682
Synonyms: methyl3,3,3- trifluoro- N- (phenylsulfonyl)- 2- {[4- (trifluoromethyl)phenyl]amino}alaninate
Smiles: COC(=O)C(C(F)(F)F)(NS(=O)(=O)c1ccccc1)Nc1ccc(cc1)C(F)(F)F

STK838048
Synonyms: 2- hydroxy- N'- [(3Z)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- 2- propylpentanehydrazide
Smiles: CCCC(C(=O)N/N=C/1\C(=O)Nc2c1cccc2)(CCC)O

STK535687
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- 7- methyl- 5- phenylpyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(c1)nc(cc2C)c1ccccc1)NCCCn1cncc1

STK838054
Synonyms: ethyl2- ({[5- (furan- 2- yl)- 7- (trifluoromethyl)- 4,5,6,7- tetrahydropyrazolo[1,5- a]pyrimidin- 2- yl]carbonyl}amino)- 4,5- dimethylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc3n(n2)C(CC(N3)c2ccco2)C(F)(F)F)sc(c1C)C

STK838055
Synonyms: 5- cyano- 6- ({2- [(2,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- N- (2- methylphenyl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK838057
Synonyms: N- (3,4- dimethoxyphenyl)- 2- methylbenzo[h]quinolin- 4- amine
Smiles: COc1cc(ccc1OC)Nc1cc(C)nc2c1ccc1c2cccc1

STK535695
Synonyms: methyl2- amino- 3- cyano- 5,6- dimethylpyridine- 4- carboxylate
Smiles: COC(=O)c1c(C)c(C)nc(c1C#N)N

STK838058
Synonyms: (5,7- diphenylpyrazolo[1,5- a]pyrimidin- 2- yl)(pyrrolidin- 1- yl)methanone
Smiles: O=C(c1nn2c(c1)nc(cc2c1ccccc1)c1ccccc1)N1CCCC1

STK535696
Synonyms: methyl5,6a- bis(4- chlorophenyl)- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: COC(=O)C1=NNC2(C1C(=O)N(C2=O)c1ccc(cc1)Cl)c1ccc(cc1)Cl

STL036489
Synonyms: [3- (2- hydroxy- 5- methylphenyl)- 1H- pyrazol- 4- yl](4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1c[nH]nc1c1cc(C)ccc1O

STK535701
Synonyms: N'- {hydroxy[bis(3- methylphenyl)]acetyl}- 2- methoxy- N- phenylbenzohydrazide
Smiles: COc1ccccc1C(=O)N(c1ccccc1)NC(=O)C(c1cccc(c1)C)(c1cccc(c1)C)O

STK838067
Synonyms: 2- {[3- cyano- 6- oxo- 4- (thiophen- 2- yl)- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc3c2cccc3)NC(=O)CC1c1cccs1

STK838068
Synonyms: 2- (hexylsulfanyl)- 4- (5- methylfuran- 2- yl)- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: CCCCCCSC1=C(C#N)C(CC(=O)N1)c1ccc(o1)C

STK838071
Synonyms: N- [(1E)- 6- bromo- 2,3,4,9- tetrahydro- 1H- carbazol- 1- ylidene]- 1- phenylmethanamine
Smiles: Brc1ccc2c(c1)c1CCC/C(=N\Cc3ccccc3)/c1[nH]2

STK838072
Synonyms: ethyl2- ({[4- bromo- 5- methyl- 3- (trifluoromethyl)- 1H- pyrazol- 1- yl]acetyl}amino)- 4,5- dimethylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)Br)C(F)(F)F)sc(c1C)C

STK535709
Synonyms: 2- butyl- N'- [(E)- (4- ethoxyphenyl)methylidene]- 2- hydroxyhexanehydrazide
Smiles: CCCCC(C(=O)N/N=C/c1ccc(cc1)OCC)(CCCC)O

STL036490
Synonyms: [3- (2- hydroxy- 5- methoxyphenyl)- 1H- pyrazol- 4- yl](3- methylphenyl)methanone
Smiles: COc1ccc(c(c1)c1n[nH]cc1C(=O)c1cccc(c1)C)O

STK535712
Synonyms: ethylN- (3- carbamoyl- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 2- [(chloroacetyl)amino]- 3,3,3- trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C(=O)N)CCCC2)NC(=O)CCl

STK535716
Synonyms: N- (quinoxalin- 2- yl)acetamide
Smiles: CC(=O)Nc1cnc2c(n1)cccc2

STK838076
Synonyms: N- benzyl- 5- (4- ethoxyphenyl)- 7- methylpyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1cc(C)n2c(n1)cc(n2)C(=O)NCc1ccccc1

STK838078
Synonyms: 4- (2,4- dichlorophenyl)- 2- (methylsulfanyl)- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SC)NC(=O)CC1c1ccc(cc1Cl)Cl

STK535721
Synonyms: 3- amino- 1,1- bis(ethylsulfanyl)- 4- phenyl- 4,5,6,7,8,9- hexahydro- 1H- pyrrolo[3,4- c]quinoline- 3a,9b- dicarbonitrile
Smiles: CCSC1(SCC)N=C(C2(C1(C#N)C1=C(CCCC1)NC2c1ccccc1)C#N)N

STK838084
Synonyms: 5- cyano- 4- (furan- 2- yl)- 2- methyl- N- (2- methylphenyl)- 6- [(2- oxo- 2- phenylethyl)sulfanyl]- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccccc2)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK838086
Synonyms: 2- [4- (furan- 2- yl)- 3H- 1,5- benzodiazepin- 2- yl]- 4- methylphenol
Smiles: Cc1ccc(c(c1)C1=Nc2ccccc2N=C(C1)c1ccco1)O

STK535735
Synonyms: 2- hydroxy- N'- [(E)- (4- methoxyphenyl)methylidene]- 4- methyl- 2- (2- methylpropyl)pentanehydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)C(CC(C)C)(CC(C)C)O

STK838088
Synonyms: N- (4- chlorophenyl)- 5,7- diphenylpyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc2n(n1)c(cc(n2)c1ccccc1)c1ccccc1

STK535738
Synonyms: 3- bromo- N- (2,4- dimethoxyphenyl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: COc1ccc(c(c1)OC)NC(=O)c1coc(=O)c(c1)Br

STK838089
Synonyms: (4Z)- 4- [(1- acetyl- 3- phenyl- 1H- pyrazol- 4- yl)methylidene]- 2- (4- tert- butylphenyl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1cn(nc1c1ccccc1)C(=O)C)c1ccc(cc1)C(C)(C)C

STK838095
Synonyms: 2- [(1,5- dicyano- 4- oxo- 3- azaspiro[5.5]undec- 1- en- 2- yl)sulfanyl]- N- (4- ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSC1=C(C#N)C2(C(C(=O)N1)C#N)CCCCC2

STK535745
Synonyms: N'- [(E)- (2- hydroxyquinolin- 3- yl)methylidene]- 2,3- dihydro- 1,4- benzodioxine- 6- carbohydrazide
Smiles: O=C(c1ccc2c(c1)OCCO2)N/N=C/c1cc2ccccc2nc1O

STK838098
Synonyms: butyl{[4- (3- chlorophenyl)- 3- cyano- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetate
Smiles: CCCCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1cccc(c1)Cl

STK535749
Synonyms: (3E)- N- (2,4- difluorophenyl)- 3- {2- [(2- hydroxyphenyl)carbonyl]hydrazinylidene}butanamide
Smiles: O=C(Nc1ccc(cc1F)F)C/C(=N/NC(=O)c1ccccc1O)/C

STK535751
Synonyms: (3- tert- butyl- 1- methyl- 4- nitro- 1H- pyrazol- 5- yl)(morpholin- 4- yl)methanone
Smiles: O=C(c1n(C)nc(c1[N+](=O)[O-])C(C)(C)C)N1CCOCC1

STK838101
Synonyms: N- (3- butoxyphenyl)- 2- {[3- cyano- 4- (4- ethoxy- 3- methoxyphenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetamide
Smiles: CCCCOc1cccc(c1)NC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(c(c1)OC)OCC

STK535760
Synonyms: 2- [1,3- dimethyl- 8- (4- methylpiperazin- 1- yl)- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl]acetamide
Smiles: CN1CCN(CC1)c1nc2c(n1CC(=O)N)c(=O)n(c(=O)n2C)C

STK838104
Synonyms: S- methyl(2- methyl- 4- oxopentan- 2- yl)carbamothioate
Smiles: CSC(=O)NC(CC(=O)C)(C)C

STK535767
Synonyms: (4Z)- 2- (thiophen- 2- yl)- 4- (thiophen- 2- ylmethylidene)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1cccs1)c1cccs1

STK838107
Synonyms: 2- (ethylsulfanyl)- 6- oxo- 4- [4- (propan- 2- yl)phenyl]- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: CCSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)C(C)C

STK838108
Synonyms: (2Z)- 3- [(4- ethoxyphenyl)amino]- 1,3- diphenylprop- 2- en- 1- one
Smiles: CCOc1ccc(cc1)N/C(=C\C(=O)c1ccccc1)/c1ccccc1

STK535773
Synonyms: methyl6- ({2- [(5- chloro- 2- methoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (4- chlorophenyl)- 5- cyano- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1cc(Cl)ccc1OC

STK535777
Synonyms: 1- cyclohexyl- 5- (dimethylamino)- 1- phenylpent- 3- yn- 1- ol
Smiles: CN(CC#CCC(c1ccccc1)(C1CCCCC1)O)C

STK535779
Synonyms: 6- tert- butyl- 2- [(4- fluorophenyl)carbonyl]spiro[2.5]octane- 1,1- dicarbonitrile
Smiles: N#CC1(C#N)C(C21CCC(CC2)C(C)(C)C)C(=O)c1ccc(cc1)F

STK838115
Synonyms: 2- [4- bromo- 5- methyl- 3- (trifluoromethyl)- 1H- pyrazol- 1- yl]- N- (3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)acetamide
Smiles: N#Cc1c(NC(=O)Cn2nc(c(c2C)Br)C(F)(F)F)sc2c1CCCCC2

STK535784
Synonyms: phenyl6- [(4- fluorophenyl)sulfamoyl]- 2- oxo- 1,3- benzoxazole- 3(2H)- carboxylate
Smiles: Fc1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C(=O)Oc1ccccc1

STK535785
Synonyms: N'- [(E)- (5- bromo- 2- hydroxyphenyl)methylidene]- 2- (2,6- dimethoxyphenoxy)acetohydrazide
Smiles: COc1cccc(c1OCC(=O)N/N=C/c1cc(Br)ccc1O)OC

STK535790
Synonyms: 4- (4- benzylpiperazin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: c1ccc(cc1)CN1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1

STK535797
Synonyms: 7- (4- bromophenyl)- 8- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 1,3- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Brc1ccc(cc1)c1cn2c(n1c1ccc3c(c1)OCCO3)nc1c2c(=O)n(c(=O)n1C)C

STK838122
Synonyms: ethyl5- (thiophen- 2- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 3- carboxylate
Smiles: CCOC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1cccs1

STK535802
Synonyms: 1'- (3,4- dichlorophenyl)- 2'H,5'H- spiro[bicyclo[2.2.1]hept- 5- ene- 2,3'- pyrrolidine]- 2',5'- dione
Smiles: O=C1CC2(C(=O)N1c1ccc(c(c1)Cl)Cl)CC1CC2C=C1

STK535803
Synonyms: 6- ({2- [(3- bromophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)Br)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK838124
Synonyms: diethyl5- ({[5- (4- ethoxyphenyl)- 7- methylpyrazolo[1,5- a]pyrimidin- 2- yl]carbonyl}amino)- 3- methylthiophene- 2,4- dicarboxylate
Smiles: CCOc1ccc(cc1)c1cc(C)n2c(n1)cc(n2)C(=O)Nc1sc(c(c1C(=O)OCC)C)C(=O)OCC

STK838126
Synonyms: 2- [(E)- 2- (4- methoxyphenyl)ethenyl]- 5,6,7,8- tetrahydro- 4H- [1]benzothieno[2,3- d][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)/C=C/c1oc(=O)c2c(n1)sc1c2CCCC1

STK535804
Synonyms: 3- tert- butyl- N,N- diethyl- 1- methyl- 4- nitro- 1H- pyrazole- 5- carboxamide
Smiles: CCN(C(=O)c1n(C)nc(c1[N+](=O)[O-])C(C)(C)C)CC

STK535805
Synonyms: N- butyl- 2- (2- methylphenyl)quinazolin- 4- amine
Smiles: CCCCNc1nc(nc2c1cccc2)c1ccccc1C

STK838133
Synonyms: 4- {[(E)- (3- ethoxy- 4- hydroxyphenyl)methylidene]amino}- 1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: CCOc1cc(/C=N/c2c(C)n(n(c2=O)c2ccccc2)C)ccc1O

STK535810
Synonyms: 2- (8- hexyl- 8- methyl- 3- oxohexahydro- 7H- [1,3]thiazolo[3,2- a]pyrazin- 7- yl)acetohydrazide
Smiles: CCCCCCC1(C)N(CCN2C1SCC2=O)CC(=O)NN

STK535813
Synonyms: methylN- [(4- chlorophenyl)carbonyl]- 3,3,3- trifluoro- 2- (2- phenylhydrazinyl)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1)Cl)NNc1ccccc1

STK838137
Synonyms: 2- ethyl- 2- hydroxy- N'- [(3Z)- 1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]butanehydrazide
Smiles: CCC(C(=O)N/N=C\1/c2ccccc2N(C1=O)C)(CC)O

STK838138
Synonyms: 4- chloro- 2- [4- (4- methoxyphenyl)- 3H- 1,5- benzodiazepin- 2- yl]phenol
Smiles: COc1ccc(cc1)C1=Nc2ccccc2N=C(C1)c1cc(Cl)ccc1O

STK535815
Synonyms: 2- (diethylamino)ethyl9- hydroxy- 9H- fluorene- 4- carboxylate
Smiles: CCN(CCOC(=O)c1cccc2c1c1ccccc1C2O)CC

STK535816
Synonyms: ethyl3,3,3- trifluoro- 2- [(3- fluorophenyl)amino]- N- [(2- fluorophenyl)carbonyl]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1F)Nc1cccc(c1)F

STK535819
Synonyms: N- (4- chlorophenyl)- 5- cyano- 6- ({2- [(4- ethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccc(cc1)Cl)c1ccco1

STK535820
Synonyms: 2- hydroxy- N'- [(1E)- 1- (6- hydroxy- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)ethylidene]benzohydrazide
Smiles: C/C(=N\NC(=O)c1ccccc1O)/c1c(O)[nH]c(=O)[nH]c1=O

STK535822
Synonyms: 7- chloro- N- (4- iodophenyl)- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: Ic1ccc(cc1)Nc1cc(Cl)c2c(c1[N+](=O)[O-])non2

STK535826
Synonyms: N- [3- (dimethylamino)propyl]- N'- (4- phenyl- 1,3- thiazol- 2- yl)ethanediamide
Smiles: CN(CCCNC(=O)C(=O)Nc1scc(n1)c1ccccc1)C

STK535827
Synonyms: 2- hydroxy- 2- phenylpentanehydrazide
Smiles: CCCC(c1ccccc1)(C(=O)NN)O

STK535829
Synonyms: 2- {[(2- bromophenyl)carbonyl]amino}- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylicacid
Smiles: O=C(c1ccccc1Br)Nc1sc2c(c1C(=O)O)CCC2

STK535843
Synonyms: ethylN- [(2,6- difluorophenyl)carbonyl]- 3,3,3- trifluoro- 2- hydroxyalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1c(F)cccc1F)O

STK535844
Synonyms: 5- cyano- 2- methyl- 6- ({2- [(3- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- N,4- diphenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK838157
Synonyms: 3- acetyl- 2- methyl- 1- benzofuran- 5- yl3- chlorobenzoate
Smiles: Clc1cccc(c1)C(=O)Oc1ccc2c(c1)c(C(=O)C)c(o2)C

STK838160
Synonyms: N- (3- methoxy- 5- nitrophenyl)- 2- (3- nitro- 1H- 1,2,4- triazol- 1- yl)acetamide
Smiles: COc1cc(NC(=O)Cn2cnc(n2)[N+](=O)[O-])cc(c1)[N+](=O)[O-]

STK535859
Synonyms: N'- (3,4- dimethylphenyl)- 2- (1H- indol- 1- yl)- 2- oxoacetohydrazide
Smiles: O=C(C(=O)n1ccc2c1cccc2)NNc1ccc(c(c1)C)C

STK838165
Synonyms: 8- (butylsulfanyl)- 1,3- dimethyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(SCCCC)nc2c1c(=O)n(c(=O)n2C)C

STK535871
Synonyms: N- benzyl- 4- [(2E)- 2- (4- methoxybenzylidene)hydrazinyl]- 6- methylpyrimidin- 2- amine
Smiles: COc1ccc(cc1)/C=N/Nc1cc(C)nc(n1)NCc1ccccc1

STK838168
Synonyms: N- benzyl- 6- methyl- 2- (morpholin- 4- yl)- 5- nitropyrimidin- 4- amine
Smiles: [O-][N+](=O)c1c(NCc2ccccc2)nc(nc1C)N1CCOCC1

STK535875
Synonyms: 2- {[2- (2- methylphenyl)quinazolin- 4- yl]amino}ethanol
Smiles: OCCNc1nc(nc2c1cccc2)c1ccccc1C

STK838172
Synonyms: 3- amino- 4- (5- methylfuran- 2- yl)- N- [4- (propan- 2- yl)phenyl]- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Cc1ccc(o1)c1c2CCCCc2nc2c1c(N)c(s2)C(=O)Nc1ccc(cc1)C(C)C

STK838175
Synonyms: N'- (chloroacetyl)- 2- (1H- indol- 1- yl)- N'- (3- methylphenyl)- 2- oxoacetohydrazide
Smiles: ClCC(=O)N(c1cccc(c1)C)NC(=O)C(=O)n1ccc2c1cccc2

STK535891
Synonyms: 4- (5- chloro- 2- hydroxyphenyl)- 2- [4- (hexyloxy)phenyl]- 6H- 1,3- oxazin- 6- one
Smiles: CCCCCCOc1ccc(cc1)c1oc(=O)cc(n1)c1cc(Cl)ccc1O

STK535893
Synonyms: methyl3- [(diethylamino)methyl]- 1H- indole- 7- carboxylate
Smiles: CCN(Cc1c[nH]c2c1cccc2C(=O)OC)CC

STK838177
Synonyms: 3- amino- 4- (furan- 2- yl)- N- (4- methylphenyl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1ccco1)c1c(n2)CCCC1

STK838179
Synonyms: methyl5- (4- bromophenyl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxylate
Smiles: COC(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(cc1)Br

STK535899
Synonyms: 2- chloro- 3- (4- methylpiperazin- 1- yl)naphthalene- 1,4- dione
Smiles: CN1CCN(CC1)C1=C(Cl)C(=O)c2c(C1=O)cccc2

STK838184
Synonyms: N- (4- chlorophenyl)- 2- [(1,5- dicyano- 4- oxo- 3- azaspiro[5.5]undec- 1- en- 2- yl)sulfanyl]acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Cl)NC(=O)C(C21CCCCC2)C#N

STK838185
Synonyms: dimethyl2,2'- (8- bromo- 3- methyl- 2,6- dioxo- 3,6- dihydro- 1H- purine- 1,7(2H)- diyl)diacetate
Smiles: COC(=O)Cn1c(Br)nc2c1c(=O)n(CC(=O)OC)c(=O)n2C

STK838187
Synonyms: N,N- dibutyl- 2- (pyridin- 4- yl)quinazolin- 4- amine
Smiles: CCCCN(c1nc(nc2c1cccc2)c1ccncc1)CCCC

STK838188
Synonyms: (2E)- 3- [(5- methyl- 1,2- oxazol- 3- yl)amino]- 1- (naphthalen- 1- yl)prop- 2- en- 1- one
Smiles: Cc1onc(c1)N/C=C/C(=O)c1cccc2c1cccc2

STK838190
Synonyms: 2- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- (5- propyl- 1,3,4- thiadiazol- 2- yl)acetamide
Smiles: CCCc1nnc(s1)NC(=O)CN1C(=O)c2c(C1=O)cccc2

STK838194
Synonyms: propan- 2- yl5- (4- bromophenyl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxylate
Smiles: CC(OC(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(cc1)Br)C

STK535906
Synonyms: 1- (8- fluoro- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)- 2- [(3R)- 4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]ethanone
Smiles: COc1cccc(c1)N1CCN(CC1C)CC(=O)N1CCc2c(C1)c1cc(F)ccc1[nH]2