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

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STK675501
Synonyms: 5- bromo- 3- [5- (4- fluorophenyl)- 4- phenyl- 1H- imidazol- 2- yl]- 1H- indole
Smiles: Fc1ccc(cc1)c1[nH]c(nc1c1ccccc1)c1c[nH]c2c1cc(Br)cc2

STK760571
Synonyms: 4,5- bis(4- bromophenyl)- 2- (2,5- dimethoxyphenyl)- 1H- imidazole
Smiles: COc1ccc(c(c1)c1[nH]c(c(n1)c1ccc(cc1)Br)c1ccc(cc1)Br)OC

STK760577
Synonyms: (3- nitro- 1H- pyrazol- 1- yl)(phenyl)methanone
Smiles: [O-][N+](=O)c1ccn(n1)C(=O)c1ccccc1

STK760588
Synonyms: 1- {[(11Z)- 11H- indeno[1,2- b]quinoxalin- 11- ylideneamino]oxy}- 3- phenylpropan- 1- one
Smiles: O=C(O/N=C/1\c2nc3ccccc3nc2c2c1cccc2)CCc1ccccc1

STK760594
Synonyms: 5- (3,3- dimethyl- 1- oxo- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 11- yl)- 2- ethoxyphenylacetate
Smiles: CCOc1ccc(cc1OC(=O)C)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(C)C

STK675509
Synonyms: 4- benzyl- 1- thioxo- 2,4,7,8- tetrahydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(1H)- one
Smiles: O=c1c2c3CCCc3sc2n2c(n1Cc1ccccc1)n[nH]c2=S

STK675513
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 4- methoxyphenyl}methylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1CSc1nc2c(s1)cccc2)/C=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N

STK760597
Synonyms: [1- (1,3- benzodioxol- 5- yl)- 1,3,4,9- tetrahydro- 2H- beta- carbolin- 2- yl](4- chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCc2c(C1c1ccc3c(c1)OCO3)[nH]c1c2cccc1

STK760598
Synonyms: (3,4- dichlorophenyl)[1- (4- nitrophenyl)- 1,3,4,9- tetrahydro- 2H- beta- carbolin- 2- yl]methanone
Smiles: O=C(N1CCc2c(C1c1ccc(cc1)[N+](=O)[O-])[nH]c1c2cccc1)c1ccc(c(c1)Cl)Cl

STK760601
Synonyms: [1- (4- chlorophenyl)- 1,3,4,9- tetrahydro- 2H- beta- carbolin- 2- yl](4- nitrophenyl)methanone
Smiles: Clc1ccc(cc1)C1N(CCc2c1[nH]c1c2cccc1)C(=O)c1ccc(cc1)[N+](=O)[O-]

STK675516
Synonyms: 8- bromo- 10,10,10a- trimethyl- 3,4,10,10a- tetrahydropyrimido[1,2- a]indol- 2(1H)- one
Smiles: O=C1CCN2C(N1)(C)C(C)(C)c1c2ccc(c1)Br

STK760607
Synonyms: N'- [(2E)- butan- 2- ylidene]- 2- methylfuran- 3- carbohydrazide
Smiles: CC/C(=N/NC(=O)c1ccoc1C)/C

STK675517
Synonyms: 7- {[4- (2- methoxyphenyl)piperazin- 1- yl]methyl}- 5- nitroquinolin- 8- ol
Smiles: COc1ccccc1N1CCN(CC1)Cc1cc([N+](=O)[O-])c2c(c1O)nccc2

STK675527
Synonyms: 3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 2- imino- 1,3- thiazolidin- 4- one
Smiles: O=C1CSC(=N)N1c1nonc1N

STK675529
Synonyms: 5- acetyl- 4- ethyl- 6- methyl- 3,4- dihydropyrimidin- 2(1H)- one
Smiles: CCC1NC(=O)NC(=C1C(=O)C)C

STK760617
Synonyms: (2Z,5E)- 2- [(3- methylphenyl)imino]- 5- [4- (2- methylpropoxy)benzylidene]- 1,3- thiazolidin- 4- one
Smiles: CC(COc1ccc(cc1)/C=C\1/S/C(=N\c2cccc(c2)C)/NC1=O)C

STK760620
Synonyms: 3- hydroxy- 5- (4- methylphenyl)- 4- [(4- methylphenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C1NC(=O)C(=C1C(=O)c1ccc(cc1)C)O

STK760626
Synonyms: 2- (4- fluorobenzyl)- 5- (4- fluorophenyl)- 2H- tetrazole
Smiles: Fc1ccc(cc1)Cn1nnc(n1)c1ccc(cc1)F

STK675534
Synonyms: N,N'- {[4- (naphthalen- 1- ylmethoxy)phenyl]methanediyl}bis(3- phenylpropanamide)
Smiles: O=C(NC(c1ccc(cc1)OCc1cccc2c1cccc2)NC(=O)CCc1ccccc1)CCc1ccccc1

STK760637
Synonyms: 5- (2- phenylethyl)- 3- (prop- 2- en- 1- ylsulfanyl)- 5H- [1,2,4]triazino[5,6- b]indole
Smiles: C=CCSc1nnc2c(n1)n(CCc1ccccc1)c1c2cccc1

STK760643
Synonyms: N- (4- fluorophenyl)- N'- (2- {4- [(4- methylphenyl)sulfonyl]piperazin- 1- yl}ethyl)ethanediamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)CCNC(=O)C(=O)Nc1ccc(cc1)F

STK675545
Synonyms: 5- {[4- (2- methoxyphenyl)piperazin- 1- yl]methyl}- 7- nitroquinolin- 8- ol
Smiles: COc1ccccc1N1CCN(CC1)Cc1cc([N+](=O)[O-])c(c2c1cccn2)O

STK760653
Synonyms: 2- (6- methoxy- 1,5- dinitro- 3- azabicyclo[3.3.1]non- 6- en- 3- yl)ethanol
Smiles: OCCN1CC2(CC=C(C(C1)(C2)[N+](=O)[O-])OC)[N+](=O)[O-]

STK675546
Synonyms: ethyl1- benzyl- 6- bromo- 5- hydroxy- 2- methyl- 4- (piperidin- 1- ylmethyl)- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1c(CN1CCCCC1)c(O)c(c2)Br)Cc1ccccc1

STK675547
Synonyms: [6- ethyl- 4- methyl- 2- (methylsulfanyl)- 1,6- dihydropyrimidin- 5- yl](phenyl)methanone
Smiles: CCC1NC(=NC(=C1C(=O)c1ccccc1)C)SC

STK675548
Synonyms: 5- [(4Z)- 4- benzylidene- 3- methyl- 5- oxo- 4,5- dihydro- 1H- pyrazol- 1- yl]- 2- chlorobenzoicacid
Smiles: CC1=NN(C(=O)/C/1=C\c1ccccc1)c1ccc(c(c1)C(=O)O)Cl

STK760655
Synonyms: 5- (2- fluorophenyl)- 3- hydroxy- 4- (phenylcarbonyl)- 1- (pyridin- 3- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccccc1F)c1cccnc1)c1ccccc1

STK760659
Synonyms: 2- cyclopropyl- 5- fluoro- 1H- isoindole- 1,3(2H)- dione
Smiles: Fc1ccc2c(c1)C(=O)N(C2=O)C1CC1

STK760660
Synonyms: 2- cyclooctyl- 5- fluoro- 1H- isoindole- 1,3(2H)- dione
Smiles: Fc1ccc2c(c1)C(=O)N(C2=O)C1CCCCCCC1

STK760661
Synonyms: {[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}(4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)O/N=C/1\CCCc2c1non2

STK760664
Synonyms: 2- (1,3- benzodioxol- 5- yl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=c1c2cccc3c2c(c(=O)n1c1ccc2c(c1)OCO2)ccc3

STK675555
Synonyms: 5- (4- chlorophenyl)- 6- (4- methoxyphenyl)- 7- phenyl- 2,3,6,7- tetrahydropyrrolo[3,4- e][1,4]diazepin- 8(1H)- one
Smiles: COc1ccc(cc1)C1C2=C(C(=O)N1c1ccccc1)NCCN=C2c1ccc(cc1)Cl

STK760666
Synonyms: 2- (4- methoxyphenyl)- 5- (morpholin- 4- yl)- 1,3- oxazole- 4- carbonitrile
Smiles: N#Cc1nc(oc1N1CCOCC1)c1ccc(cc1)OC

STK675558
Synonyms: ethyl5- (acetyloxy)- 6- bromo- 2- {[4- (2- hydroxyethyl)piperazin- 1- yl]methyl}- 1- methyl- 1H- indole- 3- carboxylate
Smiles: OCCN1CCN(CC1)Cc1n(C)c2c(c1C(=O)OCC)cc(c(c2)Br)OC(=O)C

STK675560
Synonyms: 6- bromo- 5- hydroxy- 1- methyl- 2- [(2- methyl- 1H- imidazol- 1- yl)methyl]- 1H- indole- 3- carboxylicacid
Smiles: Brc1cc2n(C)c(c(c2cc1O)C(=O)O)Cn1ccnc1C

STK760668
Synonyms: 2- ({5- [(methylsulfonyl)amino]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nnc(s1)NS(=O)(=O)C

STK675562
Synonyms: (1S,2S,5R)- 2- {3- [hydroxy(phenyl)methyl]- 4- phenyl- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl}- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nc(n(c1=S)c1ccccc1)C(c1ccccc1)O

STK760669
Synonyms: (1S,2S,5R)- 2- (4- cyclohexyl- 5- thioxo- 4,5- dihydro- 1H- tetrazol- 1- yl)- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nnn(c1=S)C1CCCCC1

STK760670
Synonyms: (1S,2S,5R)- 2- (4- benzyl- 5- thioxo- 4,5- dihydro- 1H- tetrazol- 1- yl)- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nnn(c1=S)Cc1ccccc1

STK675565
Synonyms: 5- (bromomethyl)- N- (3- chlorophenyl)- 4,5- dihydro- 1,3- thiazol- 2- amine
Smiles: BrCC1CN=C(S1)Nc1cccc(c1)Cl

STK760683
Synonyms: 5- amino- 3- [(Z)- 1- cyano- 2- {3- ethoxy- 4- [(4- fluorobenzyl)oxy]phenyl}ethenyl]- 1- phenyl- 1H- pyrazole- 4- carbonitrile
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)F)/C=C(/c1nn(c(c1C#N)N)c1ccccc1)\C#N

STK760706
Synonyms: ethyl2- [2- amino- 4- (4- chlorophenyl)- 3- cyano- 5- oxo- 5,6,7,8- tetrahydroquinolin- 1(4H)- yl]- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCCC2)N1C(=C(C#N)C(C2=C1CCCC2=O)c1ccc(cc1)Cl)N

STK760707
Synonyms: 2- oxo- N- ({2- [(3,4,5- trimethoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)- 2H- chromene- 3- carboxamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NNC(=S)NC(=O)c1cc2ccccc2oc1=O

STK675569
Synonyms: (1Z)- 1- {[5- (4- bromophenyl)furan- 2- yl]methylidene}- 6- methyl- 4- thioxo- 4,5- dihydrofuro[3,4- c]pyridin- 3(1H)- one
Smiles: Brc1ccc(cc1)c1ccc(o1)/C=C/1\OC(=O)c2c1cc(C)[nH]c2=S

STK760714
Synonyms: (3- amino- 1- benzofuran- 2- yl)(5- methoxy- 2- methyl- 1- benzofuran- 3- yl)methanone
Smiles: COc1ccc2c(c1)c(c(o2)C)C(=O)c1oc2c(c1N)cccc2

STK760716
Synonyms: 4- ({[4- (1,3- benzothiazol- 2- yl)phenyl]amino}methyl)- N,N- dimethylaniline
Smiles: CN(c1ccc(cc1)CNc1ccc(cc1)c1nc2c(s1)cccc2)C

STK675573
Synonyms: 1- [(4- methylphenyl)sulfonyl]- 2- phenylpropan- 2- ol
Smiles: Cc1ccc(cc1)S(=O)(=O)CC(c1ccccc1)(O)C

STK675576
Synonyms: 6- (4- fluorophenyl)- 5,7- diphenyl- 2,3,6,7- tetrahydropyrrolo[3,4- e][1,4]diazepin- 8(1H)- one
Smiles: Fc1ccc(cc1)C1C2=C(C(=O)N1c1ccccc1)NCCN=C2c1ccccc1

STK760720
Synonyms: 2- methoxy- 4- [(4- methylpiperidin- 1- yl)carbonothioyl]phenylnaphthalene- 1- carboxylate
Smiles: COc1cc(ccc1OC(=O)c1cccc2c1cccc2)C(=S)N1CCC(CC1)C

STK760735
Synonyms: 1- [4- (6- nitro- 1,3- benzothiazol- 2- yl)piperazin- 1- yl]ethanone
Smiles: CC(=O)N1CCN(CC1)c1nc2c(s1)cc(cc2)[N+](=O)[O-]

STK760742
Synonyms: ethyl4- {[(4- fluorophenyl)carbonyl]carbamothioyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=S)NC(=O)c1ccc(cc1)F

STK760744
Synonyms: (4E)- 2- (3- chlorophenyl)- 4- {[5- (2,4- dichlorophenyl)furan- 2- yl]methylidene}- 5- methyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: Clc1ccc(c(c1)Cl)c1ccc(o1)/C=C/1\C(=NN(C1=O)c1cccc(c1)Cl)C

STK760747
Synonyms: (2Z)- 2- {[5- (2,4- difluorophenyl)furan- 2- yl]methylidene}- 1- benzothiophen- 3(2H)- one
Smiles: Fc1ccc(c(c1)F)c1ccc(o1)/C=C/1\Sc2c(C1=O)cccc2

STK675591
Synonyms: 4- [4,5- bis(3- iodophenyl)- 1H- imidazol- 2- yl]benzonitrile
Smiles: N#Cc1ccc(cc1)c1nc(c([nH]1)c1cccc(c1)I)c1cccc(c1)I

STK760752
Synonyms: 2,2'- [(cyclohexylimino)dimethanediyl]bis(5- chloro- 3a,4,7,7a- tetrahydro- 1H- isoindole- 1,3(2H)- dione)
Smiles: ClC1=CCC2C(C1)C(=O)N(C2=O)CN(C1CCCCC1)CN1C(=O)C2C(C1=O)CC(=CC2)Cl

STK675594
Synonyms: 2- chloro- 5- [(4Z)- 4- (3- ethoxy- 4- hydroxy- 5- iodobenzylidene)- 3- methyl- 5- oxo- 4,5- dihydro- 1H- pyrazol- 1- yl]benzoicacid
Smiles: CCOc1cc(/C=C\2/C(=NN(C2=O)c2ccc(c(c2)C(=O)O)Cl)C)cc(c1O)I

STK760758
Synonyms: [4- amino- 6- (piperidin- 1- yl)- 1,3,5- triazin- 2- yl]methylcarbamimidothioate
Smiles: NC(=N)SCc1nc(N)nc(n1)N1CCCCC1

STK760762
Synonyms: 2- {(E)- [2- (morpholin- 4- yl)cyclopent- 2- en- 1- ylidene]methyl}- 1H- benzimidazole
Smiles: O1CCN(CC1)C1=CCC/C/1=C\c1nc2c([nH]1)cccc2

STK760765
Synonyms: 6- [(1,3- benzodioxol- 5- ylmethyl)sulfanyl]- 9H- purine
Smiles: C1Oc2c(O1)cc(cc2)CSc1ncnc2c1nc[nH]2

STK760767
Synonyms: 8- [(1- benzyl- 1H- benzimidazol- 2- yl)sulfanyl]- 1,3,7- trimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2C)Sc1nc2c(n1Cc1ccccc1)cccc2

STK760769
Synonyms: N- (2- ethyl- 6- methylphenyl)- 2- [(1,3,7- trimethyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nc2c(n1C)c(=O)n(c(=O)n2C)C)C

STK760770
Synonyms: 1,3,7- trimethyl- 8- (methylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CSc1nc2c(n1C)c(=O)n(c(=O)n2C)C

STK760771
Synonyms: 3- amino- 4- (4- nitrophenyl)- 5- oxo- 5H- indeno[1,2- b]thieno[3,2- e]pyridine- 2- carboxamide
Smiles: [O-][N+](=O)c1ccc(cc1)c1c2C(=O)c3c(c2nc2c1c(N)c(s2)C(=O)N)cccc3

STK760772
Synonyms: N- [5- ({2- [(3- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,3,4- thiadiazol- 2- yl]- 2- (morpholin- 4- yl)acetamide
Smiles: O=C(Nc1nnc(s1)SCC(=O)Nc1cccc(c1)C)CN1CCOCC1

STK760773
Synonyms: 2- ({5- [(methylsulfonyl)amino]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nnc(s1)NS(=O)(=O)C

STK760774
Synonyms: N- cyclohexyl- 2- phenyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: C1CCC(CC1)Nc1nc(nc2c1oc1c2cccc1)c1ccccc1

STK760780
Synonyms: N- (3- methoxyphenyl)- 2- ({5- [(methylsulfonyl)amino]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(s1)NS(=O)(=O)C

STK760782
Synonyms: {[5- (ethoxycarbonyl)- 6- methyl- 4- phenyl- 1,4- dihydropyrimidin- 2- yl]sulfanyl}aceticacid
Smiles: CCOC(=O)C1=C(C)NC(=NC1c1ccccc1)SCC(=O)O

STK675609
Synonyms: 1- [4- (1,3- benzothiazol- 2- yl)piperazin- 1- yl]propan- 1- one
Smiles: CCC(=O)N1CCN(CC1)c1nc2c(s1)cccc2

STK760795
Synonyms: 4- acetyl- 5- (4- fluorophenyl)- 3- hydroxy- 1- (4- hydroxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Oc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)C)O

STK760800
Synonyms: [2- (4- chlorophenyl)- 5- oxo- 1- phenyl- 4- (phenylamino)- 2,5- dihydro- 1H- pyrrol- 3- yl]aceticacid
Smiles: OC(=O)CC1=C(Nc2ccccc2)C(=O)N(C1c1ccc(cc1)Cl)c1ccccc1

STK760806
Synonyms: 4- acetyl- 3- hydroxy- 5- (4- methylphenyl)- 1- (pyridin- 2- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C1N(c2ccccn2)C(=O)C(=C1C(=O)C)O

STK760809
Synonyms: (1E)- N'- (4- nitrophenyl)ethanimidamide
Smiles: C/C(=N\c1ccc(cc1)[N+](=O)[O-])/N

STK760813
Synonyms: 1- methyl- N'- [(4- {[(1- methyl- 1H- imidazol- 2- yl)sulfanyl]methyl}phenyl)carbonyl]- 1H- pyrazole- 5- carbohydrazide
Smiles: O=C(c1ccc(cc1)CSc1nccn1C)NNC(=O)c1ccnn1C

STK760815
Synonyms: 2,5- diamino- 6a,6b- diphenyl- 3,4,6a,6b- tetrahydro- 2a,4a- diazacyclopenta[cd]pentalene- 1,6- dicarbonitrile
Smiles: N#CC1=C(N)N2C3(C1(c1ccccc1)C(=C(N3CC2)N)C#N)c1ccccc1

STK675619
Synonyms: 4- chloro- 1- (1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)butan- 1- one
Smiles: ClCCCC(=O)N1CCc2c(C1)c1ccccc1[nH]2

STK760824
Synonyms: 1,3- dimethyl- 5- (naphthalen- 1- ylmethyl)- 5- [2- (pyridin- 4- yl)ethyl]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1N(C)C(=O)C(C(=O)N1C)(CCc1ccncc1)Cc1cccc2c1cccc2

STK760825
Synonyms: 2- [2- (ethylsulfanyl)- 1H- benzimidazol- 1- yl]- 1- (piperidin- 1- yl)ethanone
Smiles: CCSc1nc2c(n1CC(=O)N1CCCCC1)cccc2

STK760827
Synonyms: (5- methyl- 2- phenylfuran- 3- yl)[4- (4- nitrophenyl)piperazin- 1- yl]methanone
Smiles: Cc1cc(c(o1)c1ccccc1)C(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STK760830
Synonyms: 1,3,3,4- tetramethyl- 3,4- dihydrobenzo[h]isoquinoline
Smiles: CC1=NC(C)(C)C(c2c1c1ccccc1cc2)C

STK760831
Synonyms: 5,7- di- tert- butyl- 2- (2- methoxyphenyl)- 2,3- dihydro- 1,3- benzoxazole
Smiles: COc1ccccc1C1Nc2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C

STK675626
Synonyms: 1- [(2- chloroethyl)sulfinyl]octane
Smiles: CCCCCCCCS(=O)CCCl

STK675627
Synonyms: 1- [(2- bromoethyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCBr

STK675628
Synonyms: 1- [(4- chlorobutyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCCCCl

STK675629
Synonyms: 1- [(chloromethyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCl

STK760836
Synonyms: 6- (trifluoromethyl)- 3- [3- (trifluoromethyl)phenyl][1,2,4]triazolo[4,3- a]pyridine
Smiles: FC(c1cccc(c1)c1nnc2n1cc(cc2)C(F)(F)F)(F)F

STK760845
Synonyms: sulfanediyldiethane- 2,1- diyldicarbamimidothioate
Smiles: NC(=N)SCCSCCSC(=N)N

STK675632
Synonyms: 1- [(2- chloroethyl)sulfonyl]dodecane
Smiles: CCCCCCCCCCCCS(=O)(=O)CCCl

STK760848
Synonyms: 6- nitro- 1- [(4- nitrobenzyl)oxy]- 1H- benzotriazole
Smiles: [O-][N+](=O)c1ccc(cc1)COn1nnc2c1cc(cc2)[N+](=O)[O-]

STK760849
Synonyms: 2- [(6- nitro- 1H- benzotriazol- 1- yl)oxy]- 1- (10H- phenothiazin- 10- yl)ethanone
Smiles: O=C(N1c2ccccc2Sc2c1cccc2)COn1nnc2c1cc(cc2)[N+](=O)[O-]

STK760850
Synonyms: 4- hydroxy- 1,3- dimethylpiperidine- 4- carbonitrile
Smiles: N#CC1(O)CCN(CC1C)C

STK760852
Synonyms: 2- methylquinolin- 6- amine
Smiles: Nc1ccc2c(c1)ccc(n2)C

STK760854
Synonyms: N- (4- oxo- 4,5- dihydro- 1,3- thiazol- 2- yl)- 2- (5H- [1,2,4]triazino[5,6- b]indol- 3- ylsulfanyl)acetamide
Smiles: O=C(NC1=NC(=O)CS1)CSc1nnc2c(n1)[nH]c1c2cccc1

STK675637
Synonyms: 2- chloro- 1- [4- (2- fluoro- 4- nitrophenyl)piperazin- 1- yl]ethanone
Smiles: ClCC(=O)N1CCN(CC1)c1ccc(cc1F)[N+](=O)[O-]

STK760862
Synonyms: N- (4- amino- 1,2,5- oxadiazol- 3- yl)- 2- (1,3- benzothiazol- 2- ylsulfanyl)acetamide
Smiles: O=C(Nc1nonc1N)CSc1nc2c(s1)cccc2

STK760863
Synonyms: 2- {4- [chloro(difluoro)methoxy]phenyl}- 4,6- dinitro- 1,2- benzothiazol- 3(2H)- one
Smiles: [O-][N+](=O)c1cc(cc2c1c(=O)n(s2)c1ccc(cc1)OC(Cl)(F)F)[N+](=O)[O-]

STK760865
Synonyms: 2- methyl- 6- nitro- 4- phenoxy- 1,2- benzothiazol- 3(2H)- one
Smiles: [O-][N+](=O)c1cc(Oc2ccccc2)c2c(c1)sn(c2=O)C

STK760871
Synonyms: 2- (benzylsulfonyl)- 4,6- dinitrobenzonitrile
Smiles: N#Cc1c(cc(cc1S(=O)(=O)Cc1ccccc1)[N+](=O)[O-])[N+](=O)[O-]

STK760875
Synonyms: ethylbeta- [(9H- fluoren- 9- ylacetyl)oxy]- N- formylphenylalaninate
Smiles: O=CNC(C(c1ccccc1)OC(=O)CC1c2ccccc2c2c1cccc2)C(=O)OCC

STK760876
Synonyms: 4,6- dinitro- 1H- indole
Smiles: [O-][N+](=O)c1cc2[nH]ccc2c(c1)[N+](=O)[O-]

STK760877
Synonyms: {[(7E)- [1,2,5]oxadiazolo[3,4- d]pyrimidin- 7(6H)- ylideneamino]oxy}(phenyl)methanone
Smiles: O=C(c1ccccc1)O/N=c\1/[nH]cnc2c1non2

STK675647
Synonyms: 5- (4- methoxyphenyl)- 1- phenyl- 3- (phenylamino)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)C1C(=C(C(=O)N1c1ccccc1)Nc1ccccc1)C(=O)c1ccccc1

STK675652
Synonyms: (8Z)- 8- {2- [4- (diethylamino)phenyl]hydrazinylidene}- 4- methyl- 2H- furo[2,3- h]chromene- 2,9(8H)- dione
Smiles: CCN(c1ccc(cc1)N/N=C/1\Oc2c(C1=O)c1oc(=O)cc(c1cc2)C)CC

STK675654
Synonyms: 4- (dibutylphosphoryl)benzoicacid
Smiles: CCCCP(=O)(c1ccc(cc1)C(=O)O)CCCC

STK760885
Synonyms: (1,3- dioxo- 2,3- dihydro- 1H- inden- 2- yl)(2- methyl- 1H- indol- 3- yl)propanedinitrile
Smiles: N#CC(c1c(C)[nH]c2c1cccc2)(C1C(=O)c2c(C1=O)cccc2)C#N

STK760886
Synonyms: (2Z)- 2- {[1- (2- fluorobenzyl)- 1H- indol- 3- yl]methylidene}- 1- benzothiophen- 3(2H)- one
Smiles: Fc1ccccc1Cn1cc(c2c1cccc2)/C=C/1\Sc2c(C1=O)cccc2

STK760887
Synonyms: [4- (1,3- benzothiazol- 2- yl)piperazin- 1- yl](4- bromophenyl)methanone
Smiles: Brc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2c(s1)cccc2

STK760892
Synonyms: 2,6- di- tert- butyl- 4- [2- (2- hydroxyphenyl)- 5,6- dimethoxy- 1H- benzimidazol- 1- yl]phenol
Smiles: COc1cc2c(cc1OC)nc(n2c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)c1ccccc1O

STK675660
Synonyms: benzyl1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indole- 2- carboxylate
Smiles: O=C(N1CCc2c(C1)c1ccccc1[nH]2)OCc1ccccc1

STK760897
Synonyms: 2- (5,7- di- tert- butyl- 2,3- dihydro- 1,3- benzoxazol- 2- yl)phenol
Smiles: Oc1ccccc1C1Nc2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C

STK760898
Synonyms: 1- (5,7- di- tert- butyl- 2,3- dihydro- 1,3- benzoxazol- 2- yl)naphthalen- 2- ol
Smiles: Oc1ccc2c(c1C1Nc3c(O1)c(cc(c3)C(C)(C)C)C(C)(C)C)cccc2

STK760899
Synonyms: N- (4- iodophenyl)- 1- methyl- 4- nitro- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1n(C)ncc1[N+](=O)[O-])Nc1ccc(cc1)I

STK760900
Synonyms: 1- methyl- N,N'- bis(2- methylphenyl)- 1H- pyrazole- 3,5- dicarboxamide
Smiles: O=C(c1nn(c(c1)C(=O)Nc1ccccc1C)C)Nc1ccccc1C

STK675667
Synonyms: N- (quinolin- 3- yl)- 4- [(2,4,6- trimethylphenyl)carbonyl]benzamide
Smiles: Cc1cc(C)c(c(c1)C)C(=O)c1ccc(cc1)C(=O)Nc1cnc2c(c1)cccc2

STK760905
Synonyms: 1- (4- propoxyphenyl)- 3- (2- thioxoimidazolidin- 1- yl)pyrrolidine- 2,5- dione
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)N1CCNC1=S

STK675672
Synonyms: 1- (4- ethoxyphenyl)- 2,5- dioxopyrrolidin- 3- ylN- (1,3- benzodioxol- 5- ylmethyl)- N'- (4- ethoxyphenyl)carbamimidothioate
Smiles: CCOc1ccc(cc1)/N=C(\SC1CC(=O)N(C1=O)c1ccc(cc1)OCC)/NCc1ccc2c(c1)OCO2

STK760907
Synonyms: 3- (2- chloro- 6- fluorophenyl)- N- (2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl)- 5- methyl- 1,2- oxazole- 4- carboxamide
Smiles: O=C(c1c(C)onc1c1c(F)cccc1Cl)NCC1COc2c(O1)cccc2

STK760913
Synonyms: 1- (3- methoxyphenyl)- 5,5- bis[2- (pyridin- 4- yl)ethyl]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cccc(c1)N1C(=O)NC(=O)C(C1=O)(CCc1ccncc1)CCc1ccncc1

STK675677
Synonyms: ethyl[1- (4- methoxyphenyl)- 3- oxo- 3- phenyl- 2- (phenylcarbonyl)propyl]carbamate
Smiles: CCOC(=O)NC(C(C(=O)c1ccccc1)C(=O)c1ccccc1)c1ccc(cc1)OC

STK760914
Synonyms: 2- (ethylsulfanyl)- 1- (2- fluorobenzyl)- 1H- benzimidazole
Smiles: CCSc1nc2c(n1Cc1ccccc1F)cccc2

STK760915
Synonyms: 5- {2- [(4- bromophenyl)sulfanyl]ethyl}- 1,3,4- thiadiazol- 2- amine
Smiles: Brc1ccc(cc1)SCCc1nnc(s1)N

STK760925
Synonyms: 3- bromo- N'- [(E)- (8- hydroxyquinolin- 5- yl)methylidene]benzohydrazide
Smiles: Brc1cccc(c1)C(=O)N/N=C/c1ccc(c2c1cccn2)O

STK760926
Synonyms: 4- (3- benzyl- 4- oxo- 1,3- thiazolidin- 2- yl)- N- [2- (4- ethylphenoxy)ethyl]benzamide
Smiles: CCc1ccc(cc1)OCCNC(=O)c1ccc(cc1)C1SCC(=O)N1Cc1ccccc1

STK760933
Synonyms: 5,6- dimethyl- 3- phenylthieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: O=c1[nH]c2sc(c(c2c(=O)n1c1ccccc1)C)C

STK760934
Synonyms: N- (4- ethoxyphenyl)- 2- [2- (ethylsulfanyl)- 1H- benzimidazol- 1- yl]acetamide
Smiles: CCOc1ccc(cc1)NC(=O)Cn1c(SCC)nc2c1cccc2

STK675682
Synonyms: 4- {5- [(4- methoxybenzyl)sulfanyl]- 1H- tetrazol- 1- yl}benzoicacid
Smiles: COc1ccc(cc1)CSc1nnnn1c1ccc(cc1)C(=O)O

STK675683
Synonyms: 2- ({4,6- dihydroxy- 5- [3- (trimethylsilyl)propyl]pyrimidin- 2- yl}sulfanyl)- 1- phenylethanone
Smiles: O=C(c1ccccc1)CSc1nc(O)c(c(n1)O)CCC[Si](C)(C)C

STK760944
Synonyms: 4,4'- (1,3- benzodioxol- 5- ylmethanediyl)bis(5- methyl- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one)
Smiles: CC1=NN(C(=O)C1C(C1C(=NN(C1=O)c1ccccc1)C)c1ccc2c(c1)OCO2)c1ccccc1

STK675700
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[4- (pyridin- 2- yl)piperazin- 1- yl]methyl}- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCN(CC1)c1ccccn1)c1nonc1N

STK675703
Synonyms: 7- bromo- 5- (morpholin- 4- ylmethyl)quinolin- 8- ol
Smiles: Brc1cc(CN2CCOCC2)c2c(c1O)nccc2

STK760959
Synonyms: N- (3'- acetyl- 2,3- dihydro- 3'H- spiro[benzo[f]thiochromene- 1,2'- [1,3,4]thiadiazol]- 5'- yl)acetamide
Smiles: CC(=O)NC1=NN(C2(S1)CCSc1c2c2ccccc2cc1)C(=O)C

STK675709
Synonyms: methyl2,6- bis(5,6- dibromo- 1,3- dioxooctahydro- 2H- 4,7- methanoisoindol- 2- yl)hexanoate
Smiles: COC(=O)C(N1C(=O)C2C(C1=O)C1CC2C(C1Br)Br)CCCCN1C(=O)C2C(C1=O)C1CC2C(C1Br)Br

STK760964
Synonyms: 4- bromo- N- (1- methoxy- 2,6- dimethyl- 4- oxocyclohexa- 2,5- dien- 1- yl)benzenesulfonamide
Smiles: COC1(NS(=O)(=O)c2ccc(cc2)Br)C(=CC(=O)C=C1C)C

STK760970
Synonyms: 2- {[5- (2- hydroxyphenyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- 1- phenylethanone
Smiles: O=C(c1ccccc1)CSc1nnc(o1)c1ccccc1O

STK675715
Synonyms: 1,1,10,10- tetraphenyl- 4,7- dioxa- 1,10- diphosphadecane1,10- dioxide
Smiles: O=P(c1ccccc1)(c1ccccc1)CCOCCOCCP(=O)(c1ccccc1)c1ccccc1

STK760977
Synonyms: 2- [2- nitro- 4- (trifluoromethyl)phenoxy]- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)COc1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK675725
Synonyms: 1,3,3- trimethyl- 4- phenylpiperidin- 4- ylacetate
Smiles: CN1CCC(C(C1)(C)C)(OC(=O)C)c1ccccc1

STK675726
Synonyms: 3- ethyl- 1- methyl- 4- phenylpiperidin- 4- ylbenzoate
Smiles: CCC1CN(C)CCC1(OC(=O)c1ccccc1)c1ccccc1

STK675727
Synonyms: 1,3,3- trimethyl- 4- phenylpiperidin- 4- ylbenzoate
Smiles: CN1CCC(C(C1)(C)C)(OC(=O)c1ccccc1)c1ccccc1

STK760986
Synonyms: methyl{[3- cyano- 6- oxo- 4- (thiophen- 3- yl)- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetate
Smiles: COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1cscc1

STK675735
Synonyms: 5- {[(4- chlorophenyl)sulfonyl]methyl}- 1,3,4- oxadiazol- 2- amine
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1nnc(o1)N

STK675736
Synonyms: 2,8- dibenzyl- 2,8- diazaspiro[5.5]undecane
Smiles: c1ccc(cc1)CN1CCCC2(C1)CCCN(C2)Cc1ccccc1

STK760993
Synonyms: 1- methyl- 3- nitro[1,2,4]triazolo[5,1- c][1,2,4]triazin- 4(1H)- one
Smiles: [O-][N+](=O)c1nn(C)c2n(c1=O)ncn2

STK675738
Synonyms: 4,6- dinitro- 1- (4- nitrophenyl)- 1H- indazole
Smiles: [O-][N+](=O)c1ccc(cc1)n1ncc2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]

STK760994
Synonyms: 7- methyl- 1,3- dinitroacridine
Smiles: Cc1ccc2c(c1)cc1c(n2)cc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK760996
Synonyms: 1- (4- methylphenyl)- 4,6- dinitro- 1H- indazole
Smiles: Cc1ccc(cc1)n1ncc2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]

STK675740
Synonyms: 2- {[(Z)- 2- nitroethenyl]amino}benzoicacid
Smiles: [O-][N+](=O)/C=C\Nc1ccccc1C(=O)O

STK761001
Synonyms: N- {(E)- [5- (4- chloro- 3- nitrophenyl)furan- 2- yl]methylidene}- 4H- 1,2,4- triazol- 4- amine
Smiles: [O-][N+](=O)c1cc(ccc1Cl)c1ccc(o1)/C=N/n1cnnc1

STK761012
Synonyms: N'- 2,1,3- benzoxadiazol- 5- yl- N,N- dimethylimidoformamide
Smiles: CN(/C=N\c1ccc2c(c1)non2)C

STK761021
Synonyms: 4- bromo- N- [(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonothioyl]benzamide
Smiles: Brc1ccc(cc1)C(=O)NC(=S)N1CC2CC(C1)c1n(C2)c(=O)ccc1

STK675754
Synonyms: 3- (2- oxo- 2H- 1,4- benzoxazin- 3- yl)propanoicacid
Smiles: OC(=O)CCc1nc2ccccc2oc1=O

STK761028
Synonyms: methyl3,3,3- trifluoro- 2- (5- methyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- {[2- oxo- 2- (phenylamino)ethyl]sulfanyl}propanoate
Smiles: COC(=O)C(C(F)(F)F)(c1c(C)[nH]n(c1=O)c1ccccc1)SCC(=O)Nc1ccccc1

STK761032
Synonyms: 4a,5,6,7,8,9,10,11,12,13,14,14a- dodecahydrocyclododeca[b][1,3]dithiolo[4,5- e][1,4]dithiine- 2- thione
Smiles: S=c1sc2c(s1)SC1C(S2)CCCCCCCCCC1

STK761035
Synonyms: 1- [4- (4- fluorophenyl)- 6- hydroxy- 3,6- dimethyl- 4,5,6,7- tetrahydro- 2,1- benzoxazol- 5- yl]ethanone
Smiles: CC(=O)C1C(c2ccc(cc2)F)c2c(C)onc2CC1(C)O

STK761038
Synonyms: 2- methoxy- 4- [(4- methylpiperidin- 1- yl)carbonothioyl]phenyl4- methoxybenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)OC)C(=S)N1CCC(CC1)C

STK761042
Synonyms: N'- [(4- chloro- 1- methyl- 1H- pyrazol- 3- yl)carbonyl]- 3- (2- chlorophenyl)- 5- methyl- 1,2- oxazole- 4- carbohydrazide
Smiles: Cn1cc(c(n1)C(=O)NNC(=O)c1c(C)onc1c1ccccc1Cl)Cl

STK761043
Synonyms: 1- (2- methoxyphenyl)- 4- [2- nitro- 4- (trifluoromethyl)phenyl]piperazine
Smiles: COc1ccccc1N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK675759
Synonyms: 7- bromo- 1- hydroxy- 3- oxo- 8- phenyl- 2- azabicyclo[2.2.2]octane- 4,5,5- tricarbonitrile
Smiles: N#CC12C(=O)NC(C(C1c1ccccc1)Br)(CC2(C#N)C#N)O

STK761044
Synonyms: N- (2,1,3- benzothiadiazol- 5- yl)thiophene- 2- carboxamide
Smiles: O=C(c1cccs1)Nc1ccc2c(c1)nsn2

STK761048
Synonyms: (1Z)- 1- (3- ethoxy- 4- hydroxybenzylidene)- 6- methylfuro[3,4- c]pyridine- 3,4(1H,5H)- dione
Smiles: CCOc1cc(ccc1O)/C=C/1\OC(=O)c2c1cc(C)[nH]c2=O

STK675760
Synonyms: 2'- bromo- 6',6'- dimethyl- 2- phenyl- 2'- (prop- 2- en- 1- ylsulfanyl)- 2,2',3,3',5',6'- hexahydro- 1'H- spiro[chromene- 4,4'- pyrimidin]- 7- ol
Smiles: C=CCSC1(Br)NC(C)(C)CC2(N1)CC(Oc1c2ccc(c1)O)c1ccccc1

STK761066
Synonyms: 3- [(2Z)- 2- [(4- ethoxyphenyl)imino]- 4- (4- fluorophenyl)- 1,3- thiazol- 3(2H)- yl]propan- 1- ol
Smiles: OCCCn1/c(=N/c2ccc(cc2)OCC)/scc1c1ccc(cc1)F

STK761070
Synonyms: 1- benzyl- 2- (ethylsulfanyl)- 1H- benzimidazole
Smiles: CCSc1nc2c(n1Cc1ccccc1)cccc2

STK761073
Synonyms: 5,7- dibromo- 2- oxo- 1,3- benzoxathiol- 6- ylmethylcarbamate
Smiles: CNC(=O)Oc1c(Br)cc2c(c1Br)oc(=O)s2

STK761075
Synonyms: 5- chloro- 2- oxo- 1,3- benzoxathiol- 6- ylphenylcarbamate
Smiles: O=C(Nc1ccccc1)Oc1cc2oc(=O)sc2cc1Cl

STK761080
Synonyms: 3- (3,7- diphenyl- 4H- 1,2- diazepin- 5- yl)- 1H- indole
Smiles: c1ccc(cc1)C1=NN=C(C=C(C1)c1c[nH]c2c1cccc2)c1ccccc1

STK761093
Synonyms: (8Z)- 8- (4- bromobenzylidene)- 4- methyl- 2H- furo[2,3- h]chromene- 2,9(8H)- dione
Smiles: Brc1ccc(cc1)/C=C/1\Oc2c(C1=O)c1oc(=O)cc(c1cc2)C

STK675770
Synonyms: 5- nitropyrimidine- 2,4,6- triamine1,3- dioxide
Smiles: [O-][N+](=O)c1c(N)[n+]([O-])c([n+](c1N)[O-])N

STK761094
Synonyms: 3- amino- 6- (methoxymethyl)- 4- methylthieno[2,3- b]pyridine- 2- carbonitrile
Smiles: COCc1cc(C)c2c(n1)sc(c2N)C#N

STK761100
Synonyms: 2- (hydroxymethyl)- 2- (pyridin- 2- yl)propane- 1,3- diol
Smiles: OCC(c1ccccn1)(CO)CO

STK761103
Synonyms: 4- chloro- N- {4- [(diaminomethylidene)sulfamoyl]phenyl}benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1ccc(cc1)S(=O)(=O)N=C(N)N

STK761107
Synonyms: 1- (phenylsulfonyl)decahydroquinolin- 4- ol
Smiles: OC1CCN(C2C1CCCC2)S(=O)(=O)c1ccccc1

STK761109
Synonyms: 3- (1,3- diphenyl- 1H- pyrazol- 5- yl)- 1- methyl- 1H- indole
Smiles: Cn1cc(c2c1cccc2)c1cc(nn1c1ccccc1)c1ccccc1

STK675784
Synonyms: 5- formyl- 2,4- dimethyl- 1H- pyrrole- 3- carbonitrile
Smiles: O=Cc1[nH]c(c(c1C)C#N)C

STK675786
Synonyms: 2- (bicyclo[2.2.1]hept- 5- en- 2- yl)- 1- [3- (morpholin- 4- yl)- 5- nitro- 1- benzofuran- 2- yl]propan- 2- ol
Smiles: [O-][N+](=O)c1ccc2c(c1)c(N1CCOCC1)c(o2)CC(C1CC2CC1C=C2)(O)C

STK761112
Synonyms: 5- (4- chlorophenyl)- 3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 1- (pyridin- 2- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Cl)c1ccccn1

STK761118
Synonyms: 4- amino- N'- {[(4- chlorophenyl)carbonyl]oxy}- 1,2,5- oxadiazole- 3- carboximidamide
Smiles: Clc1ccc(cc1)C(=O)O/N=C(/c1nonc1N)\N

STK761122
Synonyms: (3Z)- 1- [(2,6- dimethylmorpholin- 4- yl)methyl]- 3- (naphthalen- 2- ylimino)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CC1OC(C)CN(C1)CN1c2ccccc2/C(=N/c2ccc3c(c2)cccc3)/C1=O

STK761128
Synonyms: 8- methyl- 2- (4- methylphenyl)- 1,2,4- triazaspiro[4.5]decane- 3- thione
Smiles: CC1CCC2(CC1)NC(=S)N(N2)c1ccc(cc1)C

STK761131
Synonyms: 2- [(5- amino- 1,3,4- thiadiazol- 2- yl)sulfanyl]- N- (2- {[2- oxo- 2- (phenylamino)ethyl]sulfanyl}- 1,3- benzothiazol- 6- yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)Nc1ccccc1)CSc1nnc(s1)N

STK761136
Synonyms: 2- (4,5- dihydro- 1,3- thiazol- 2- ylsulfanyl)- N- [4- (trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CSC1=NCCS1

STK675813
Synonyms: 2- oxo- 2- {[4- (trifluoromethoxy)phenyl]amino}ethyl(2Z)- 3- (furan- 2- yl)prop- 2- enoate
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)COC(=O)/C=C\c1ccco1

STK761145
Synonyms: 3- methyl- N'- [(2E)- 1- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)propan- 2- ylidene]benzohydrazide
Smiles: Cc1cccc(c1)C(=O)N/N=C(/Cn1nc(cc1C)[N+](=O)[O-])\C

STK675818
Synonyms: methyl1- [(E)- (2'- hydroxy- 1,1':3',1''- terphenyl- 5'- yl)diazenyl]- 2- oxocyclopentanecarboxylate
Smiles: COC(=O)C1(CCCC1=O)/N=N/c1cc(c2ccccc2)c(c(c1)c1ccccc1)O

STK761162
Synonyms: 1- (2,6- dimethylmorpholin- 4- yl)- 2- (4- nitro- 1H- pyrazol- 1- yl)ethanone
Smiles: CC1OC(C)CN(C1)C(=O)Cn1ncc(c1)[N+](=O)[O-]

STK675820
Synonyms: 3- {[4- (ethoxycarbonyl)- 4- phenylpiperidin- 1- yl]methyl}benzoicacid
Smiles: CCOC(=O)C1(CCN(CC1)Cc1cccc(c1)C(=O)O)c1ccccc1

STK761171
Synonyms: N- [5- (1H- benzimidazol- 2- yl)- 1,3- thiazol- 2- yl]formamide
Smiles: O=CNc1ncc(s1)c1nc2c([nH]1)cccc2

STK675822
Synonyms: 1,3,4,6- tetramethyl- 2,5- dioxabicyclo[2.2.2]octane- 3,6- diol(non- preferredname)
Smiles: CC12CCC(C(O1)(C)O)(OC2(C)O)C

STK761178
Synonyms: 2- [(2- cyclopropyl- 2- oxoethyl)sulfanyl]- 4- (4- methoxyphenyl)- 6- phenylpyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)C2CC2)nc(cc1c1ccc(cc1)OC)c1ccccc1

STK675853
Synonyms: 1- [4- (3- fluorophenyl)- 6- hydroxy- 3,6- dimethyl- 4,5,6,7- tetrahydro- 2,1- benzoxazol- 5- yl]ethanone
Smiles: CC(=O)C1C(c2cccc(c2)F)c2c(C)onc2CC1(C)O

STK761196
Synonyms: 5- (4- fluorophenyl)- 3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)NC1c1ccc(cc1)F

STK761205
Synonyms: (2E)- 3- phenyl- 2- [(2E)- (pyridin- 3- ylmethylidene)hydrazinylidene]- 1,3- thiazolidin- 4- one
Smiles: O=C1CS/C(=N/N=C/c2cccnc2)/N1c1ccccc1

STK761206
Synonyms: 2,3,4- trimethoxy- 6,8- dioxabicyclo[3.2.1]octane(non- preferredname)
Smiles: COC1C(OC)C2OCC(C1OC)O2

STK761207
Synonyms: 2,3,4- tris(benzyloxy)- 6,8- dioxabicyclo[3.2.1]octane(non- preferredname)
Smiles: c1ccc(cc1)COC1C(OCc2ccccc2)C2OCC(C1OCc1ccccc1)O2

STK761208
Synonyms: (1R,2R,4R,6R)- 3,7,9- trioxatricyclo[4.2.1.0~2,4~]non- 5- yl4- methylbenzenesulfonate(non- preferredname)
Smiles: Cc1ccc(cc1)S(=O)(=O)OC1[C@@H]2OC[C@@H](O2)[C@H]2[C@@H]1O2

STK675857
Synonyms: (1R,2R,4R,5R,6R)- 5- (benzyloxy)- 3,8,9- trioxatricyclo[4.2.1.0~2,4~]nonane(non- preferredname)
Smiles: c1ccc(cc1)CO[C@@H]1[C@H]2CO[C@H](O2)[C@@H]2[C@H]1O2

STK761212
Synonyms: N- (4- amino- 2,5- diethoxyphenyl)benzamide
Smiles: CCOc1cc(N)c(cc1NC(=O)c1ccccc1)OCC

STK675861
Synonyms: 7,7,9,9- tetramethyl- 4- methylidene- 1,3- dioxa- 8- azaspiro[4.5]decan- 2- one
Smiles: C=C1OC(=O)OC21CC(C)(C)NC(C2)(C)C

STK761214
Synonyms: benzo[1,2- c:3,4- c':5,6- c'']tris[1,2,5]oxadiazole1,4,9- trioxide
Smiles: [O-][n+]1onc2c1c1no[n+](c1c1c2no[n+]1[O-])[O-]

STK675866
Synonyms: 4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- ol
Smiles: Oc1nsnc1N1CCOCC1

STK761215
Synonyms: 4- methyl- 5- methylidene- 4- [2- (2,6,6- trimethylcyclohex- 1- en- 1- yl)ethyl]- 1,3- dioxolan- 2- one
Smiles: O=C1OC(=C)C(O1)(C)CCC1=C(C)CCCC1(C)C

STK761217
Synonyms: 2- amino- 7- methyl- 5H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 5- one
Smiles: Cc1cc(=O)n2c(n1)sc(n2)N

STK761219
Synonyms: ethyl[({(Z)- [(4,6- dimethylpyrimidin- 2- yl)amino][(1H- 1,2,4- triazol- 5- ylsulfonyl)amino]methylidene}amino)oxy]acetate
Smiles: CCOC(=O)CO/N=C(\NS(=O)(=O)c1ncn[nH]1)/Nc1nc(C)cc(n1)C

STK761222
Synonyms: 2,6- dichloro- N- (4- methoxyphenyl)- 4- methylpyridine- 3- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(C)cc(nc1Cl)Cl

STK761229
Synonyms: 1- (2- chlorophenyl)- 3- (4- methylpyridin- 2- yl)urea
Smiles: O=C(Nc1ccccc1Cl)Nc1nccc(c1)C

STK761233
Synonyms: 1- (2- chlorophenyl)- 3- quinolin- 8- ylurea
Smiles: O=C(Nc1cccc2c1nccc2)Nc1ccccc1Cl

STK761234
Synonyms: 2,6- dichloro- 4- methylpyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(nc1Cl)Cl

STK675876
Synonyms: 2,6- dichloro- N- [(4- chlorophenyl)carbamoyl]- 4- methyl- 5- nitropyridine- 3- carboxamide
Smiles: O=C(NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])Cl)Nc1ccc(cc1)Cl

STK761236
Synonyms: N- (butylcarbamoyl)- 2,6- dichloro- 4- methyl- 5- nitropyridine- 3- carboxamide
Smiles: CCCCNC(=O)NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])Cl

STK675877
Synonyms: ethyl5- chloro- 4- hydroxy- 6- methyl- 2- oxo- 1,2- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)c1c(=O)[nH]c(c(c1O)Cl)C

STK761240
Synonyms: N- (butylcarbamoyl)- 2- chloro- 4,6- dimethylpyridine- 3- sulfonamide
Smiles: CCCCNC(=O)NS(=O)(=O)c1c(C)cc(nc1Cl)C

STK675881
Synonyms: 1- (3- chlorophenyl)- 3- (4,6- dimethyl- 1H- pyrazolo[3,4- b]pyridin- 3- yl)urea
Smiles: O=C(Nc1n[nH]c2c1c(C)cc(n2)C)Nc1cccc(c1)Cl

STK761241
Synonyms: 2,6- dichloro- N- (4- chlorophenyl)- 4- methylpyridine- 3- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1c(C)cc(nc1Cl)Cl

STK761244
Synonyms: N- benzyl- N- methyl- 1H- 1,2,4- triazole- 5- sulfonamide
Smiles: CN(S(=O)(=O)c1ncn[nH]1)Cc1ccccc1

STK675882
Synonyms: 1- benzyl- N- (cyclohexylcarbamoyl)- 1H- 1,2,4- triazole- 3- sulfonamide
Smiles: O=C(NS(=O)(=O)c1ncn(n1)Cc1ccccc1)NC1CCCCC1

STK761245
Synonyms: N~2~- [(5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)sulfonyl]- 3- methylisovalinamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)S(=O)(=O)NC(C(=O)N)(C(C)C)C

STK675884
Synonyms: (1E)- 1- (1,3- benzodioxol- 5- ylmethylidene)- 6- methylfuro[3,4- c]pyridine- 3,4(1H,3aH)- dione
Smiles: O=C1O/C(=C/c2ccc3c(c2)OCO3)/C2=CC(=NC(=O)C12)C

STK675887
Synonyms: 5- [(4- acetyl- 3,5- dimethyl- 1H- pyrrol- 2- yl)methyl]- 4- ethyl- 3- methyl- 1H- pyrrole- 2- carboxylicacid
Smiles: CCc1c(Cc2[nH]c(c(c2C)C(=O)C)C)[nH]c(c1C)C(=O)O

STK675889
Synonyms: 2,6- dichloro- 4- methyl- 5- nitro- N- {[2- (trifluoromethyl)phenyl]carbamoyl}pyridine- 3- carboxamide
Smiles: O=C(NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])Cl)Nc1ccccc1C(F)(F)F

STK675890
Synonyms: 2- chloro- N- (2,4,5- trichlorophenyl)benzenesulfonamide
Smiles: Clc1cc(Cl)c(cc1NS(=O)(=O)c1ccccc1Cl)Cl

STK675891
Synonyms: 2,4,5- trichlorobenzenesulfonamide
Smiles: Clc1cc(c(cc1Cl)Cl)S(=O)(=O)N

STK675892
Synonyms: 5,7- dimethyl- N- (prop- 2- en- 1- yl)[1,2,4]triazolo[1,5- a]pyrimidine- 2- sulfonamide
Smiles: C=CCNS(=O)(=O)c1nn2c(n1)nc(cc2C)C

STK675893
Synonyms: N- (3- fluorophenyl)- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- sulfonamide
Smiles: Fc1cccc(c1)NS(=O)(=O)c1nn2c(n1)nc(cc2C)C

STK761253
Synonyms: 1- chloro- 4- [(1Z)- 3- hydroxy- 3- phenyltriaz- 1- en- 1- yl]anthracene- 9,10- dione
Smiles: ON(c1ccccc1)/N=N\c1ccc(c2c1C(=O)c1ccccc1C2=O)Cl

STK761259
Synonyms: 5,7- dibromo- 2- oxo- 1,3- benzoxathiol- 6- ylbutylcarbamate
Smiles: CCCCNC(=O)Oc1c(Br)cc2c(c1Br)oc(=O)s2

STK761269
Synonyms: 2,7- dioxo- 2,7- dihydro- 3H- naphtho[1,2,3- de]quinoline- 1- carbonitrile
Smiles: N#Cc1c(=O)[nH]c2c3c1c1ccccc1c(=O)c3ccc2

STK761272
Synonyms: 4- [(3- methyl- 2,7- dioxo- 2,7- dihydro- 3H- naphtho[1,2,3- de]quinolin- 6- yl)amino]benzaldehyde
Smiles: O=Cc1ccc(cc1)Nc1ccc2c3c1c(=O)c1ccccc1c3cc(=O)n2C

STK675903
Synonyms: ethyl6- methyl- 2- ({[(4- methyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nncn2C)sc2c1CCC(C2)C

STK761279
Synonyms: 2- (dimethylamino)ethyl5- methoxy- 1,2- dimethyl- 1H- indole- 3- carboxylate
Smiles: COc1ccc2c(c1)c(C(=O)OCCN(C)C)c(n2C)C

STK761282
Synonyms: 1- hydroxy- N- (4- methoxyphenyl)- 9,10- dioxo- 9,10- dihydroanthracene- 2- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1ccc2c(c1O)C(=O)c1c(C2=O)cccc1

STK761283
Synonyms: 4- acetyl- 3- hydroxy- 1- (4- hydroxyphenyl)- 5- (4- methoxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)C1N(c2ccc(cc2)O)C(=O)C(=C1C(=O)C)O

STK675905
Synonyms: 4- {3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 2- oxo- 5- phenyl- 2,5- dihydro- 1H- pyrrol- 1- yl}- 1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)c1c(C)n(n(c1=O)c1ccccc1)C

STK761286
Synonyms: 6- chloro- 2- (3- fluorophenyl)- 4H- chromen- 4- one
Smiles: Clc1ccc2c(c1)c(=O)cc(o2)c1cccc(c1)F

STK761287
Synonyms: 2- (3- fluorophenyl)- 6- methyl- 4H- chromen- 4- one
Smiles: Cc1ccc2c(c1)c(=O)cc(o2)c1cccc(c1)F

STK675915
Synonyms: 7- chloro- 5- {[4- (2- methoxyphenyl)piperazin- 1- yl]methyl}quinolin- 8- ol
Smiles: COc1ccccc1N1CCN(CC1)Cc1cc(Cl)c(c2c1cccn2)O

STK675918
Synonyms: N- [2- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,3- benzothiazol- 6- yl]- 2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)Nc1ccc(c(c1)Cl)C)CSc1nnc(s1)C

STK675920
Synonyms: ethyl2- amino- 5- oxo- 4- phenyl- 1- (4- sulfamoylphenyl)- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: CCOC(=O)C1=C(N)N(C2=C(C1c1ccccc1)C(=O)CCC2)c1ccc(cc1)S(=O)(=O)N

STK675925
Synonyms: 2- ethoxy- 4- [(4- methylpiperidin- 1- yl)carbonothioyl]phenyl4- nitrobenzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-])C(=S)N1CCC(CC1)C

STK675927
Synonyms: 2,3,3,3- tetrafluoro- 2- (heptafluoropropoxy)- N- (6- methylpyridin- 2- yl)propanamide
Smiles: O=C(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)Nc1cccc(n1)C

STK675930
Synonyms: (1E)- 1- [3- iodo- 5- methoxy- 4- (prop- 2- yn- 1- yloxy)benzylidene]- 2- [2,3,5,6- tetrafluoro- 4- (trifluoromethyl)phenyl]hydrazine
Smiles: C#CCOc1c(I)cc(cc1OC)/C=N/Nc1c(F)c(F)c(c(c1F)F)C(F)(F)F

STK761341
Synonyms: [4- methyl- 6- (thiophen- 2- yl)- 1,5,2- dioxazinan- 2- yl](phenyl)methanone
Smiles: CC1CN(OC(O1)c1cccs1)C(=O)c1ccccc1

STK675933
Synonyms: 4- {2- (4- chlorophenyl)- 3- [(4- chlorophenyl)carbonyl]- 4- hydroxy- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}- N- (1,3- thiazol- 2- yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)C1N(c2ccc(cc2)S(=O)(=O)Nc2nccs2)C(=O)C(=C1C(=O)c1ccc(cc1)Cl)O

STK675937
Synonyms: ethyl(4- oxo- 1,3,4,6,7,11b- hexahydro- 2H- pyrazino[2,1- a]isoquinolin- 3- yl)acetate
Smiles: CCOC(=O)CC1NCC2N(C1=O)CCc1c2cccc1

STK675945
Synonyms: 7- chloro- 5- (morpholin- 4- ylmethyl)quinolin- 8- ol
Smiles: Clc1cc(CN2CCOCC2)c2c(c1O)nccc2

STK761364
Synonyms: quinolin- 8- yl3- (azepan- 1- ylsulfonyl)benzoate
Smiles: O=C(c1cccc(c1)S(=O)(=O)N1CCCCCC1)Oc1cccc2c1nccc2

STK761365
Synonyms: N'- [(E)- (7- methoxy- 2- oxo- 1,3- benzoxathiol- 5- yl)methylidene]pyridine- 3- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2cccnc2)cc2c1oc(=O)s2

STK675949
Synonyms: 6- bromo- N- (2- phenoxyethyl)- 2- phenylquinoline- 4- carboxamide
Smiles: Brc1ccc2c(c1)c(cc(n2)c1ccccc1)C(=O)NCCOc1ccccc1

STK761373
Synonyms: N- [2,2,2- trichloro- 1- (2- methyl- 1H- indol- 3- yl)ethyl]benzenesulfonamide
Smiles: Cc1[nH]c2c(c1C(C(Cl)(Cl)Cl)NS(=O)(=O)c1ccccc1)cccc2

STK761374
Synonyms: N- [2,2,2- trichloro- 1- (1H- indol- 3- yl)ethyl]benzenesulfonamide
Smiles: ClC(C(c1c[nH]c2c1cccc2)NS(=O)(=O)c1ccccc1)(Cl)Cl

STK761376
Synonyms: 1- amino- 6- bromo- 4- methyl- 3H- naphtho[1,2,3- de]quinoline- 2,7- dione
Smiles: Cc1cc(Br)c2c3c1[nH]c(=O)c(c3c1c(c2=O)cccc1)N

STK761382
Synonyms: 6- amino- 4- (3,4- dimethoxyphenyl)- 3- methyl- 1- (4- methylphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC)c(C)nn2c1ccc(cc1)C

STK761385
Synonyms: 6- amino- 4- (2- fluorophenyl)- 3- methyl- 1- (4- methylphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1F)c(C)nn2c1ccc(cc1)C

STK761396
Synonyms: 6- amino- 4- (5- chloro- 3- methyl- 1- phenyl- 1H- pyrazol- 4- yl)- 3- methyl- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c(C)nn(c1Cl)c1ccccc1)c(C)[nH]n2

STK675956
Synonyms: propan- 2- yl5- cyano- 2- methyl- 6- sulfanyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(S)NC(=C(C1c1cccs1)C(=O)OC(C)C)C

STK761406
Synonyms: 6- amino- 4- (2- ethoxy- 4- hydroxyphenyl)- 3- propyl- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: CCCc1n[nH]c2c1C(C(=C(O2)N)C#N)c1ccc(cc1OCC)O

STK761408
Synonyms: 6- amino- 4- (3- ethoxy- 4- hydroxyphenyl)- 3- (methoxymethyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: COCc1n[nH]c2c1C(c1ccc(c(c1)OCC)O)C(=C(O2)N)C#N

STK675961
Synonyms: ethyl4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 3- oxobutanoate
Smiles: CCOC(=O)CC(=O)CN1C(=O)c2c(C1=O)cccc2

STK761419
Synonyms: N- [(2Z,5Z)- 5- (1- acetyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 4- oxo- 1,3- thiazolidin- 2- ylidene]acetamide
Smiles: CC(=O)/N=C\1/NC(=O)/C(=C\2/C(=O)N(c3c2cccc3)C(=O)C)/S1

STK761423
Synonyms: 5- chloro- 3- ({[3- (trifluoromethyl)phenyl]amino}methyl)- 1,3- benzoxazole- 2(3H)- thione
Smiles: Clc1ccc2c(c1)n(CNc1cccc(c1)C(F)(F)F)c(=S)o2

STK761446
Synonyms: 1- amino- 4- methyl- 3H- naphtho[1,2,3- de]quinoline- 2,7- dione
Smiles: Cc1ccc2c3c1[nH]c(=O)c(c3c1c(c2=O)cccc1)N

STK761448
Synonyms: 1- (butylamino)- 3H- naphtho[1,2,3- de]quinoline- 2,7- dione
Smiles: CCCCNc1c(=O)[nH]c2c3c1c1ccccc1c(=O)c3ccc2

STK761451
Synonyms: 6- (2,5- dimethoxyphenyl)- 3- methyl- 5H- [1,2,4]triazolo[4,3- b][1,2,4]triazole
Smiles: COc1ccc(cc1c1[nH]n2c(n1)nnc2C)OC

STK761454
Synonyms: 2- [(2,5- dioxo- 1- phenylpyrrolidin- 3- yl)sulfanyl]- 6- (thiophen- 2- yl)- 4- (trifluoromethyl)pyridine- 3- carbonitrile
Smiles: N#Cc1c(SC2CC(=O)N(C2=O)c2ccccc2)nc(cc1C(F)(F)F)c1cccs1

STK675972
Synonyms: 3- (2- chloroethyl)- 2- hydroxyquinazolin- 4(3H)- one
Smiles: ClCCn1c(O)nc2c(c1=O)cccc2

STK675973
Synonyms: 5- [(2- methyl- 4- nitro- 1H- imidazol- 1- yl)methyl]- 1,3,4- thiadiazol- 2- amine
Smiles: Nc1nnc(s1)Cn1cc(nc1C)[N+](=O)[O-]

STK761462
Synonyms: 1- {2- [(1,3- dimethyl- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene)methyl]- 4- nitrophenyl}piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)c1ccc(cc1C=C1C(=O)N(C)C(=O)N(C1=O)C)[N+](=O)[O-]

STK761463
Synonyms: N'- [(4Z,5E)- 5- (hydroxyimino)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylidene]benzohydrazide
Smiles: O/N=C/1\CCc2c(\C1=N\NC(=O)c1ccccc1)non2

STK761467
Synonyms: 2- (benzylsulfanyl)- 4,6- dinitrobenzamide
Smiles: [O-][N+](=O)c1cc(SCc2ccccc2)c(c(c1)[N+](=O)[O-])C(=O)N

STK675975
Synonyms: 4- azido- 6- nitro- 2- phenyl- 1,2- benzothiazol- 3(2H)- one
Smiles: [N-]=[N+]=Nc1cc(cc2c1c(=O)n(s2)c1ccccc1)[N+](=O)[O-]

STK761469
Synonyms: trimethyl2,2',2''- [(2- cyanobenzene- 1,3,5- triyl)trisulfanediyl]triacetate
Smiles: COC(=O)CSc1cc(SCC(=O)OC)c(c(c1)SCC(=O)OC)C#N

STK675976
Synonyms: 2- (benzylsulfanyl)- 4,6- dimethoxybenzonitrile
Smiles: COc1cc(SCc2ccccc2)c(c(c1)OC)C#N

STK761470
Synonyms: methyl3- amino- 4,6- dinitro- 1- benzothiophene- 2- carboxylate
Smiles: COC(=O)c1sc2c(c1N)c(cc(c2)[N+](=O)[O-])[N+](=O)[O-]

STK761473
Synonyms: 4- [(E)- {[1- (5- chloro- 1H- indol- 3- yl)propan- 2- yl]imino}methyl]- N,N- dimethylaniline
Smiles: Clc1ccc2c(c1)c(c[nH]2)CC(/N=C/c1ccc(cc1)N(C)C)C

STK675980
Synonyms: propan- 2- yl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CC(OC(=O)c1nnn(c1CN1CCN(CC1)c1ccc(cc1)F)c1nonc1N)C

STK761477
Synonyms: (8Z)- 4- methyl- 8- (2- phenylhydrazinylidene)- 2H- furo[2,3- h]chromene- 2,9(8H)- dione
Smiles: O=c1cc(C)c2c(o1)c1c(cc2)O/C(=N\Nc2ccccc2)/C1=O

STK761486
Synonyms: ethyl4- {(2E)- 3- (1,3- benzodioxol- 5- yl)- 2- [(thiophen- 2- ylcarbonyl)amino]prop- 2- enoyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1cccs1

STK761487
Synonyms: 4- bromo- 2- (7,8- dimethyl- 1,5- dihydro- 2,4- benzodithiepin- 3- yl)phenol
Smiles: Brc1ccc(c(c1)C1SCc2c(CS1)cc(c(c2)C)C)O

STK761490
Synonyms: 3- (4- chlorophenyl)- 7,8- dimethyl- 1,5- dihydro- 2,4- benzodithiepine
Smiles: Clc1ccc(cc1)C1SCc2c(CS1)cc(c(c2)C)C

STK761491
Synonyms: 5- oxo- 5- [(2,4,6- trichlorophenyl)amino]pentane- 1,2,3,4- tetrayltetraacetate(non- preferredname)
Smiles: O=C(C(C(C(OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)Nc1c(Cl)cc(cc1Cl)Cl

STK761503
Synonyms: 2- (7,8- dimethyl- 1,5- dihydro- 2,4- benzodithiepin- 3- yl)- 5- methylphenol
Smiles: Cc1ccc(c(c1)O)C1SCc2c(CS1)cc(c(c2)C)C

STK761508
Synonyms: 5- [(2,4- dimethylphenyl)amino]- 5- oxopentane- 1,2,3,4- tetrayltetraacetate(non- preferredname)
Smiles: CC(=O)OC(C(C(OC(=O)C)COC(=O)C)OC(=O)C)C(=O)Nc1ccc(cc1C)C

STK675982
Synonyms: ethyl4- (biphenyl- 4- yl)- 2- {[2,3,4,5- tetrakis(acetyloxy)pentanoyl]amino}thiophene- 3- carboxylate(non- preferredname)
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)c1ccccc1)NC(=O)C(C(C(OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C

STK761515
Synonyms: 4- chloro- N- [2,2,2- trichloro- 1- (2- methyl- 1H- indol- 3- yl)ethyl]benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)NC(C(Cl)(Cl)Cl)c1c(C)[nH]c2c1cccc2

STK761520
Synonyms: 2- {[4- (morpholin- 4- yl)- 6- (propan- 2- ylamino)- 1,3,5- triazin- 2- yl]amino}ethanol
Smiles: OCCNc1nc(NC(C)C)nc(n1)N1CCOCC1

STK761521
Synonyms: 1- [4- (4- chlorophenyl)- 6- hydroxy- 3,6- dimethyl- 4,5,6,7- tetrahydro- 2,1- benzoxazol- 5- yl]ethanone
Smiles: CC(=O)C1C(c2ccc(cc2)Cl)c2c(C)onc2CC1(C)O

STK675989
Synonyms: 4- ethanimidoyl- 3- hydroxy- 1- methyl- 5- phenyl- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CC(=N)C1=C(O)C(=O)N(C1c1ccccc1)C

STK675990
Synonyms: 1- methyl- 4- phenylisoquinoline
Smiles: Cc1ncc(c2c1cccc2)c1ccccc1

STK675993
Synonyms: 6- (4- fluorophenyl)- 5- phenyl- 7- [3- (trifluoromethyl)phenyl]- 2,3,6,7- tetrahydropyrrolo[3,4- e][1,4]diazepin- 8(1H)- one
Smiles: Fc1ccc(cc1)C1N(c2cccc(c2)C(F)(F)F)C(=O)C2=C1C(=NCCN2)c1ccccc1

STK761536
Synonyms: 2- [(4- {[4- methyl- 6- (trifluoromethyl)pyrimidin- 2- yl]sulfanyl}butanoyl)amino]- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophene- 3- carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCCCCC2)CCCSc1nc(C)cc(n1)C(F)(F)F

STK675995
Synonyms: 1- (2- oxo- 1- oxaspiro[4.5]dec- 3- en- 4- yl)piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)C1=CC(=O)OC21CCCCC2

STK675998
Synonyms: 4- hydroxy- 4,7,7,9,9- pentamethyl- 3- (2,2,6,6- tetramethylpiperidin- 4- yl)- 1- oxa- 3,8- diazaspiro[4.5]decan- 2- one
Smiles: O=C1OC2(C(N1C1CC(C)(C)NC(C1)(C)C)(C)O)CC(C)(C)NC(C2)(C)C

STK675999
Synonyms: dimethyl(3- methoxy- 6- nitro- 1,2- benzothiazol- 4- yl)phosphoramidate
Smiles: COc1nsc2c1c(cc(c2)[N+](=O)[O-])NP(=O)(OC)OC

STK676001
Synonyms: 1,5- diethoxy- 2,4- dinitrobenzene
Smiles: CCOc1cc(OCC)c(cc1[N+](=O)[O-])[N+](=O)[O-]

STK676002
Synonyms: 5- (dimethylamino)pyrimidine- 2,4(1H,3H)- dione
Smiles: CN(c1c[nH]c(=O)[nH]c1=O)C

STK761542
Synonyms: 6- (difluoromethyl)- 4- (2- methylpropyl)- 5- [(methylsulfanyl)carbonyl]- 2- (trifluoromethyl)pyridine- 3- carbothioicS- acid
Smiles: CSC(=O)c1c(nc(c(c1CC(C)C)C(=O)S)C(F)(F)F)C(F)F

STK676003
Synonyms: 3- (decylsulfanyl)propanoicacid
Smiles: CCCCCCCCCCSCCC(=O)O

STK676005
Synonyms: 7- (butylsulfanyl)heptanoicacid
Smiles: CCCCSCCCCCCC(=O)O

STK761545
Synonyms: 4- methyl- N- [(5Z)- 7- nitro- 5H- indeno[1,2- b]pyridin- 5- ylidene]aniline
Smiles: Cc1ccc(cc1)/N=C/1\c2cccnc2c2c1cc(cc2)[N+](=O)[O-]

STK676006
Synonyms: N,N,N',N'- tetraethyl- 4- phenylpyridine- 3,5- dicarboxamide
Smiles: CCN(C(=O)c1cncc(c1c1ccccc1)C(=O)N(CC)CC)CC

STK761548
Synonyms: methyl8- methyl- 1,2- bis(propylsulfonyl)indolizine- 3- carboxylate
Smiles: CCCS(=O)(=O)c1c2c(C)cccn2c(c1S(=O)(=O)CCC)C(=O)OC

STK761550
Synonyms: 2,6- dimethoxy- 4- {5- phenyl- 4- [4- (phenylsulfanyl)phenyl]- 1H- imidazol- 2- yl}phenol
Smiles: COc1cc(cc(c1O)OC)c1nc(c([nH]1)c1ccccc1)c1ccc(cc1)Sc1ccccc1

STK761552
Synonyms: 2- (4- chlorobenzyl)- 2- (4- chlorophenyl)- 1H- indene- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)CC1(c2ccc(cc2)Cl)C(=O)c2c(C1=O)cccc2

STK676013
Synonyms: 6- (3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (2- methylphenyl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: Cc1cc(n(n1)c1nc2nonc2nc1Nc1ccccc1C)C

STK761561
Synonyms: (2Z)- 2- {[5- (2- fluorophenyl)furan- 2- yl]methylidene}- 1- benzothiophen- 3(2H)- one
Smiles: Fc1ccccc1c1ccc(o1)/C=C/1\Sc2c(C1=O)cccc2

STK761567
Synonyms: 2- (2- chlorophenyl)- 7- hydroxy- 6',6'- dimethyl- 2,3,5',6'- tetrahydro- 1'H- spiro[chromene- 4,4'- pyrimidine]- 2'(3'H)- thione
Smiles: S=C1NC(C)(C)CC2(N1)CC(Oc1c2ccc(c1)O)c1ccccc1Cl

STK761568
Synonyms: 6- chloro- 2- (2- chlorophenyl)- 7- hydroxy- 6',6'- dimethyl- 2,3,5',6'- tetrahydro- 1'H- spiro[chromene- 4,4'- pyrimidine]- 2'(3'H)- thione
Smiles: S=C1NC(C)(C)CC2(N1)CC(Oc1c2cc(Cl)c(c1)O)c1ccccc1Cl

STK676024
Synonyms: 2- (2- imino- 6- methoxy- 1,3- benzothiazol- 3(2H)- yl)ethanol
Smiles: OCCn1c(=N)sc2c1ccc(c2)OC

STK676025
Synonyms: 3- cyclopropylprop- 2- ynoicacid
Smiles: OC(=O)C#CC1CC1

STK676027
Synonyms: ethylcarbamothioylhydrazonoformate
Smiles: CCO/C=N/NC(=S)N

STK761573
Synonyms: 3,4,5- triphenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: O=C1N(c2ccccc2)C(c2c1n[nH]c2c1ccccc1)c1ccccc1

STK761574
Synonyms: spiro[1,3- benzoxazine- 2,1'- cyclohexane]- 4(3H)- thione
Smiles: S=C1NC2(CCCCC2)Oc2c1cccc2

STK676031
Synonyms: 3- (butylsulfanyl)- 5- [(2- oxo- 2- phenylethyl)sulfanyl]- 1,2- thiazole- 4- carbonitrile
Smiles: CCCCSc1nsc(c1C#N)SCC(=O)c1ccccc1

STK761581
Synonyms: (3Z,6E)- 5- (2- fluorobenzyl)- 2,8- dioxa- 3,4,6,7- tetraazanona- 3,6- diene4,6- dioxide
Smiles: CO/N=[N+](\C(/[N+](=N/OC)/[O-])Cc1ccccc1F)/[O-]

STK761586
Synonyms: 4,4'- (1,4,2,5- dioxadiazine- 3,6- diyl)bis(1,2,5- oxadiazol- 3- amine)
Smiles: Nc1nonc1C1=NOC(=NO1)c1nonc1N

STK761596
Synonyms: 2- [(2- bromobenzyl)sulfanyl]- 4- oxo- 3- azaspiro[5.5]undec- 1- ene- 1,5- dicarbonitrile
Smiles: N#CC1C(=O)NC(=C(C21CCCCC2)C#N)SCc1ccccc1Br

STK761599
Synonyms: 5,7- dichloroquinolin- 8- ylnaphthalene- 1- sulfonate
Smiles: Clc1cc(Cl)c2c(c1OS(=O)(=O)c1cccc3c1cccc3)nccc2

STK761603
Synonyms: 5,7- dichloroquinolin- 8- yl4- butoxybenzenesulfonate
Smiles: CCCCOc1ccc(cc1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761604
Synonyms: 5,7- dichloroquinolin- 8- yl2,4- dimethylbenzenesulfonate
Smiles: Cc1ccc(c(c1)C)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761605
Synonyms: 5,7- dichloroquinolin- 8- ylbenzenesulfonate
Smiles: Clc1cc(Cl)c2c(c1OS(=O)(=O)c1ccccc1)nccc2

STK761609
Synonyms: 5,7- dichloroquinolin- 8- yl5- iodo- 2- methylbenzenesulfonate
Smiles: Ic1ccc(c(c1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl)C

STK761611
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- [(5- ethyl- 5H- [1,2,4]triazino[5,6- b]indol- 3- yl)sulfanyl]acetamide
Smiles: CCn1c2ccccc2c2c1nc(SCC(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C)nn2

STK676036
Synonyms: 2- [(8- bromo- 5- methyl- 5H- [1,2,4]triazino[5,6- b]indol- 3- yl)sulfanyl]- N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)acetamide
Smiles: O=C(Nc1c(=O)n(n(c1C)C)c1ccccc1)CSc1nnc2c(n1)n(C)c1c2cc(cc1)Br

STK761617
Synonyms: 3- (4- bromophenyl)- 4,4- dimethyl- 2- oxaspiro[5.5]undecane- 1,5- dione
Smiles: Brc1ccc(cc1)C1OC(=O)C2(C(=O)C1(C)C)CCCCC2

STK761618
Synonyms: 3- (4- methoxyphenyl)- 4,4- dimethyl- 2- oxaspiro[5.5]undecane- 1,5- dione
Smiles: COc1ccc(cc1)C1OC(=O)C2(C(=O)C1(C)C)CCCCC2

STK676038
Synonyms: 7,8- dimethyl- 4- (trifluoromethyl)- 1,3- dihydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: O=C1CC(=Nc2c(N1)cc(C)c(c2)C)C(F)(F)F

STK761626
Synonyms: N- phenyl[1,2,5]oxadiazolo[3,4- e][1,2,4]triazolo[4,3- a]pyrazin- 5- amine
Smiles: c1ccc(cc1)Nc1nc2nonc2n2c1nnc2

STK676040
Synonyms: (3Z)- 3- (2- {6- [(4- methylphenyl)amino][1,2,5]oxadiazolo[3,4- b]pyrazin- 5- yl}hydrazinylidene)- 1,3- dihydro- 2H- indol- 2- one
Smiles: Cc1ccc(cc1)Nc1nc2nonc2nc1N/N=C/1\C(=O)Nc2c1cccc2

STK761648
Synonyms: 4- nitro- 1- (prop- 1- en- 2- yl)- 1,3- dihydro- 2H- benzimidazol- 2- one
Smiles: [O-][N+](=O)c1cccc2c1[nH]c(=O)n2C(=C)C

STK676043
Synonyms: 4- hydroxy- 3,4,5- trimethyl- 5- [2- (2,6,6- trimethylcyclohex- 1- en- 1- yl)ethyl]- 1,3- oxazolidin- 2- one
Smiles: CC1=C(CCC2(C)OC(=O)N(C2(C)O)C)C(CCC1)(C)C

STK761653
Synonyms: 4- acetyl- 5- (2- fluorophenyl)- 1- (4- fluorophenyl)- 3- hydroxy- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1F)C(=O)C)O

STK761660
Synonyms: 5,7- dichloroquinolin- 8- yl2,4- dichloro- 5- methylbenzenesulfonate
Smiles: Clc1cc(Cl)c(cc1C)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761663
Synonyms: 5,7- dichloroquinolin- 8- yl2,4- dibromobenzenesulfonate
Smiles: Brc1ccc(c(c1)Br)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761664
Synonyms: 5,7- dichloroquinolin- 8- ylnaphthalene- 2- sulfonate
Smiles: Clc1cc(Cl)c2c(c1OS(=O)(=O)c1ccc3c(c1)cccc3)nccc2

STK761665
Synonyms: 5,7- dichloroquinolin- 8- yl5- chloro- 2- methylbenzenesulfonate
Smiles: Clc1ccc(c(c1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl)C

STK676047
Synonyms: 5,7- dibromoquinolin- 8- yl5- bromo- 2- methoxybenzenesulfonate
Smiles: COc1ccc(cc1S(=O)(=O)Oc1c(Br)cc(c2c1nccc2)Br)Br

STK761668
Synonyms: 5- chloro- 1- [(2,5- dimethylphenyl)sulfonyl]- 1H- benzotriazole
Smiles: Clc1ccc2c(c1)nnn2S(=O)(=O)c1cc(C)ccc1C

STK761670
Synonyms: 5,7- dichloroquinolin- 8- yl4- chloro- 2- methylbenzenesulfonate
Smiles: Clc1ccc(c(c1)C)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK676048
Synonyms: 5,7- dibromoquinolin- 8- yl2,3,4- trichlorobenzenesulfonate
Smiles: Brc1cc(Br)c2c(c1OS(=O)(=O)c1ccc(c(c1Cl)Cl)Cl)nccc2

STK761676
Synonyms: 5,7- dichloroquinolin- 8- yl2,5- dimethylbenzenesulfonate
Smiles: Cc1ccc(c(c1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl)C

STK761677
Synonyms: 5,7- dibromoquinolin- 8- ylfuran- 2- carboxylate
Smiles: Brc1cc(Br)c2c(c1OC(=O)c1ccco1)nccc2

STK761678
Synonyms: N- (2,3- dimethylphenyl)- 2- oxo- 8- (prop- 2- en- 1- yl)- 2H- chromene- 3- carboxamide
Smiles: C=CCc1cccc2c1oc(=O)c(c2)C(=O)Nc1cccc(c1C)C

STK761685
Synonyms: 5,7- dichloroquinolin- 8- ylfuran- 2- carboxylate
Smiles: Clc1cc(Cl)c2c(c1OC(=O)c1ccco1)nccc2

STK761687
Synonyms: 1- [(1,1- dioxido- 1,2- benzothiazol- 3- yl)(methyl)amino]- 3- phenoxypropan- 2- yl2- bromobenzoate
Smiles: O=C(c1ccccc1Br)OC(CN(C1=NS(=O)(=O)c2c1cccc2)C)COc1ccccc1

STK761688
Synonyms: 4- [(1,1- dioxido- 1,2- benzothiazol- 3- yl)amino]phenyl4- methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1ccc(cc1)NC1=NS(=O)(=O)c2c1cccc2

STK761689
Synonyms: 3- [(1,1- dioxido- 1,2- benzothiazol- 3- yl)(phenyl)amino]propyl4- methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)OCCCN(C1=NS(=O)(=O)c2c1cccc2)c1ccccc1

STK676050
Synonyms: 3- (2- {[2- (2- methylphenoxy)ethyl]sulfanyl}- 1H- benzimidazol- 1- yl)propanoicacid
Smiles: OC(=O)CCn1c(SCCOc2ccccc2C)nc2c1cccc2

STK676053
Synonyms: [(3E)- 3- {2- [(2- hydroxyphenyl)carbonyl]hydrazinylidene}- 2- oxo- 2,3- dihydro- 1H- indol- 1- yl]aceticacid
Smiles: OC(=O)CN1c2ccccc2/C(=N\NC(=O)c2ccccc2O)/C1=O

STK676054
Synonyms: {(3E)- 2- oxo- 3- [2- (5H- [1,2,4]triazino[5,6- b]indol- 3- yl)hydrazinylidene]- 2,3- dihydro- 1H- indol- 1- yl}aceticacid
Smiles: OC(=O)CN1C(=O)/C(=N/Nc2nnc3c(n2)[nH]c2c3cccc2)/c2c1cccc2

STK761697
Synonyms: 2- amino- 4- (1,3- benzodioxol- 5- yl)- 1- (3- chloro- 4- methylphenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(c(c2)Cl)C)C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2

STK761705
Synonyms: 4- [(4- chloro- 3- methylphenyl)sulfonyl]morpholine
Smiles: Clc1ccc(cc1C)S(=O)(=O)N1CCOCC1

STK676057
Synonyms: 5,6- bis(2- methylpiperidin- 1- yl)[1,2,5]oxadiazolo[3,4- b]pyrazine
Smiles: CC1CCCCN1c1nc2nonc2nc1N1CCCCC1C

STK761713
Synonyms: 5,7- dibromoquinolin- 8- yl5- chloro- 2- methylbenzenesulfonate
Smiles: Clc1ccc(c(c1)S(=O)(=O)Oc1c(Br)cc(c2c1nccc2)Br)C

STK761715
Synonyms: 5,7- dibromoquinolin- 8- yl4- chloro- 2- methylbenzenesulfonate
Smiles: Clc1ccc(c(c1)C)S(=O)(=O)Oc1c(Br)cc(c2c1nccc2)Br

STK761722
Synonyms: 5,7- dichloroquinolin- 8- yl4- methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761723
Synonyms: 5,7- dibromoquinolin- 8- yl2,5- dimethylbenzenesulfonate
Smiles: Cc1ccc(c(c1)S(=O)(=O)Oc1c(Br)cc(c2c1nccc2)Br)C

STK676062
Synonyms: 2- (1,3- benzothiazol- 2- ylcarbamoyl)- 4- methylbenzoicacid
Smiles: Cc1ccc(c(c1)C(=O)Nc1nc2c(s1)cccc2)C(=O)O

STK761731
Synonyms: 8,10a- dihydroxy- 1,10a- dihydro- 2H- chromeno[2,3- d]pyrimidine- 2,4(3H)- dione
Smiles: O=C1NC(=O)C2=Cc3c(OC2(N1)O)cc(cc3)O

STK761736
Synonyms: (3E)- 5- (3,4- dimethylphenyl)- 3- {[1- (2- fluorophenyl)- 1H- pyrrol- 2- yl]methylidene}furan- 2(3H)- one
Smiles: O=C1OC(=C/C/1=C\c1cccn1c1ccccc1F)c1ccc(c(c1)C)C

STK761745
Synonyms: 5- (2,4- dimethoxyphenyl)- 3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)NC1c1ccc(cc1OC)OC

STK676066
Synonyms: 2- {[hydroxy(diphenyl)acetyl]amino}- N- (2- methylphenyl)benzamide
Smiles: O=C(c1ccccc1NC(=O)C(c1ccccc1)(c1ccccc1)O)Nc1ccccc1C

STK761750
Synonyms: (2E,5Z)- 3- methyl- 2- (methylimino)- 5- [(3- methylthiophen- 2- yl)methylidene]- 1,3- thiazolidin- 4- one
Smiles: C/N=C\1/S/C(=C\c2sccc2C)/C(=O)N1C

STK761754
Synonyms: 2- methoxy- 4- {(Z)- [(2Z)- 4- oxo- 3- phenyl- 2- (phenylimino)- 1,3- thiazolidin- 5- ylidene]methyl}phenyldimethylcarbamate
Smiles: COc1cc(ccc1OC(=O)N(C)C)/C=C/1\S/C(=N\c2ccccc2)/N(C1=O)c1ccccc1

STK761760
Synonyms: (2E)- 2- [(1- benzyl- 1H- indol- 3- yl)methylidene]- 7,8- dimethyl[1,3]thiazolo[3,2- a]benzimidazol- 3(2H)- one
Smiles: Cc1ccc2c(c1C)nc1n2c(=O)/c(=C\c2cn(c3c2cccc3)Cc2ccccc2)/s1

STK761773
Synonyms: N- (2- hydroxyethyl)- 2- (2- methyl- 4- nitro- 1H- imidazol- 1- yl)acetamide
Smiles: [O-][N+](=O)c1cn(c(n1)C)CC(=O)NCCO

STK761778
Synonyms: 8- (dimethylamino)- 1,3- dimethyl- 7- (2- oxo- 2- phenylethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=C(c1ccccc1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N(C)C

STK676071
Synonyms: 7- [2- (4- chlorophenyl)- 2- oxoethyl]- 1,3- dimethyl- 8- (morpholin- 4- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(cc1)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1

STK761784
Synonyms: (6E)- 6- (furan- 2- ylmethylidene)- 1,3- dimethyl- 3a,9a- diphenyl- 3,3a,9,9a- tetrahydroimidazo[4,5- e][1,3]thiazolo[3,2- b][1,2,4]triazine- 2,7(1H,6H)- dione
Smiles: O=c1/c(=C\c2ccco2)/sc2=NC3(C(Nn12)(c1ccccc1)N(C)C(=O)N3C)c1ccccc1

STK761786
Synonyms: ethyl4- (dimethylamino)- 6- methyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)NC1N(C)C

STK761792
Synonyms: propan- 2- yl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(pyridin- 2- ylsulfanyl)methyl]- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CC(OC(=O)c1nnn(c1CSc1ccccn1)c1nonc1N)C

STK676076
Synonyms: propan- 2- yl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4- ethylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)OC(C)C

STK761796
Synonyms: 3- [(7- chloroquinolin- 4- yl)amino]naphthalene- 2- carboxylicacid
Smiles: Clc1ccc2c(c1)nccc2Nc1cc2ccccc2cc1C(=O)O

STK761800
Synonyms: 1'- (piperidin- 1- ylmethyl)spiro[1,3- dioxane- 2,3'- indol]- 2'(1'H)- one
Smiles: O=C1N(CN2CCCCC2)c2c(C31OCCCO3)cccc2

STK676081
Synonyms: (3Z)- 5- bromo- 3- [(4- methoxyphenyl)imino]- 1- [(4- methylpiperidin- 1- yl)methyl]- 1,3- dihydro- 2H- indol- 2- one
Smiles: COc1ccc(cc1)/N=C\1/c2cc(Br)ccc2N(C1=O)CN1CCC(CC1)C

STK761806
Synonyms: [4- (1,3- benzothiazol- 2- yl)piperazin- 1- yl](4- chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2c(s1)cccc2

STK676083
Synonyms: N- {(1E)- 1- (furan- 2- yl)- 3- [(3- methylphenyl)amino]- 3- oxoprop- 1- en- 2- yl}thiophene- 3- carboxamide
Smiles: Cc1cccc(c1)NC(=O)/C(=C\c1ccco1)/NC(=O)c1ccsc1

STK761813
Synonyms: N- [(1E)- 3- [(2- methoxyphenyl)amino]- 3- oxo- 1- (thiophen- 2- yl)prop- 1- en- 2- yl]thiophene- 3- carboxamide
Smiles: COc1ccccc1NC(=O)/C(=C\c1cccs1)/NC(=O)c1ccsc1

STK761815
Synonyms: N- [(1E)- 1- (furan- 2- yl)- 3- oxo- 3- {[3- (trifluoromethyl)phenyl]amino}prop- 1- en- 2- yl]thiophene- 3- carboxamide
Smiles: O=C(/C(=C\c1ccco1)/NC(=O)c1cscc1)Nc1cccc(c1)C(F)(F)F

STK761820
Synonyms: (2Z)- 2- (2,4- difluorobenzylidene)[1,3]thiazolo[3,2- a]benzimidazol- 3(2H)- one
Smiles: Fc1ccc(c(c1)F)/C=c/1\sc2n(c1=O)c1c(n2)cccc1

STK761821
Synonyms: (2Z)- 2- [(3- methylthiophen- 2- yl)methylidene]- 5,6- diphenylimidazo[2,1- b][1,3]thiazol- 3(2H)- one
Smiles: Cc1ccsc1/C=c/1\sc2n(c1=O)c(c(n2)c1ccccc1)c1ccccc1

STK761823
Synonyms: propan- 2- yl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CC(OC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)C

STK761824
Synonyms: N- {2- [(2- chloropyridin- 3- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}benzamide
Smiles: O=C(c1ccccc1)NC(C(F)(F)F)(C(F)(F)F)Nc1cccnc1Cl

STK676093
Synonyms: 6,6'- benzene- 1,2- diylbis(1,3,5- triazine- 2,4- diamine)
Smiles: Nc1nc(nc(n1)N)c1ccccc1c1nc(N)nc(n1)N

STK761836
Synonyms: 4- (5- phenyl- 1,2,4- oxadiazol- 3- yl)- 1,2,5- oxadiazol- 3- amine
Smiles: Nc1nonc1c1noc(n1)c1ccccc1

STK761837
Synonyms: 1- phenyl- 1,3a,4,4a,5,7a,8,8a- octahydro- 4,8- methanoindeno[5,6- d][1,2,3]triazole
Smiles: C1=CC2C(C1)C1CC2C2C1N=NN2c1ccccc1

STK761841
Synonyms: 2- amino- 5- iodo- 6- (3- methoxyphenoxy)pyrimidin- 4(3H)- one
Smiles: COc1cccc(c1)Oc1nc(N)[nH]c(=O)c1I

STK761842
Synonyms: 4- methoxy- 6- [2- (prop- 2- en- 1- yl)phenoxy]pyrimidin- 2- amine
Smiles: C=CCc1ccccc1Oc1cc(OC)nc(n1)N

STK761851
Synonyms: 4- (2- chlorophenyl)- 5- cyano- 6- (ethylsulfanyl)- 2- phenyl- 1,2,3,4- tetrahydropyridin- 2- ylbenzoate
Smiles: CCSC1=C(C#N)C(CC(N1)(OC(=O)c1ccccc1)c1ccccc1)c1ccccc1Cl

STK761852
Synonyms: 4- (2- chlorophenyl)- 5- cyano- 6- (methylsulfanyl)- 2- phenyl- 1,2,3,4- tetrahydropyridin- 2- ylbenzoate
Smiles: CSC1=C(C#N)C(CC(N1)(OC(=O)c1ccccc1)c1ccccc1)c1ccccc1Cl

STK761859
Synonyms: ethyl1- [(2- hydroxyphenyl)carbonyl]- 4- phenylpiperidine- 4- carboxylate
Smiles: CCOC(=O)C1(CCN(CC1)C(=O)c1ccccc1O)c1ccccc1

STK676102
Synonyms: 2,2'- {[6- (piperidin- 1- yl)- 1,3,5- triazine- 2,4- diyl]diimino}diaceticacid(non- preferredname)
Smiles: OC(=O)CNc1nc(NCC(=O)O)nc(n1)N1CCCCC1

STK761872
Synonyms: (1S,2S,5R)- 2- [3- (3,4- dimethoxyphenyl)- 4- methyl- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl]- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: COc1cc(ccc1OC)c1nn(c(=S)n1C)[C@H]1CC(=O)[C@H]2O[C@@H]1CO2

STK761874
Synonyms: (1S,2S,5R)- 2- [3- (2,4- dichlorophenyl)- 4- (prop- 2- en- 1- yl)- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl]- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: C=CCn1c(nn(c1=S)[C@H]1CC(=O)[C@H]2O[C@@H]1CO2)c1ccc(cc1Cl)Cl

STK761876
Synonyms: 4- hydroxy- 3,4- dimethyl- 1- oxa- 3- azaspiro[4.5]decan- 2- one
Smiles: CN1C(=O)OC2(C1(C)O)CCCCC2

STK761877
Synonyms: methyl3,6- diamino- 5- cyano- 4- (3,4- dimethoxyphenyl)thieno[2,3- b]pyridine- 2- carboxylate
Smiles: N#Cc1c(N)nc2c(c1c1ccc(c(c1)OC)OC)c(N)c(s2)C(=O)OC

STK761879
Synonyms: prop- 2- yn- 1- ylcyclohexylidene[(phenylcarbonyl)amino]acetate
Smiles: C#CCOC(=O)C(=C1CCCCC1)NC(=O)c1ccccc1

STK761881
Synonyms: (3Z)- 1- ethyl- 3- (4- oxo- 3- phenyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CCN1C(=O)/C(=C/2\SC(=S)N(C2=O)c2ccccc2)/c2c1cccc2

STK761897
Synonyms: N- (4- chlorophenyl)- 5- (3,4- dichlorophenyl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc2n(n1)c(cc(n2)c1ccc(c(c1)Cl)Cl)C(F)(F)F

STK761899
Synonyms: morpholin- 4- yl[7- (trifluoromethyl)- 5,6- dihydrobenzo[h]pyrazolo[5,1- b]quinazolin- 10- yl]methanone
Smiles: O=C(c1nn2c(c1)nc1c(c2C(F)(F)F)CCc2c1cccc2)N1CCOCC1

STK761901
Synonyms: 3- chloro- 5- (4- fluorophenyl)- N- (propan- 2- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CC(NC(=O)c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1ccc(cc1)F)C

STK761905
Synonyms: 3- chloro- 5- (4- fluorophenyl)- N- (2- methoxyethyl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: COCCNC(=O)c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1ccc(cc1)F

STK761916
Synonyms: 5- (4- methylphenyl)- N- (propan- 2- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 3- carboxamide
Smiles: CC(NC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccc(cc1)C)C

STK761926
Synonyms: methyl2,4- dihydroxy- 1- (4- methoxyphenyl)- 5- oxo- 3- (phenylcarbonyl)- 2,5- dihydro- 1H- pyrrole- 2- carboxylate
Smiles: COC(=O)C1(O)N(c2ccc(cc2)OC)C(=O)C(=C1C(=O)c1ccccc1)O

STK676127
Synonyms: 4- ({(Z)- [1- (4- chlorophenyl)- 3- methyl- 5- oxo- 1,5- dihydro- 4H- pyrazol- 4- ylidene]methyl}amino)benzoicacid
Smiles: Clc1ccc(cc1)N1N=C(/C(=C/Nc2ccc(cc2)C(=O)O)/C1=O)C

STK761940
Synonyms: (4Z)- 4- (5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 1- (3,4- dichlorophenyl)pyrazolidine- 3,5- dione
Smiles: Brc1ccc2c(c1)/C(=C/1\C(=O)NN(C1=O)c1ccc(c(c1)Cl)Cl)/C(=O)N2

STK761941
Synonyms: ethyl4- cyano- 3- methyl- 5- ({(Z)- [1- (3- methylphenyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}amino)thiophene- 2- carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)C

STK761942
Synonyms: ethyl2- ({(Z)- [1- (4- chlorophenyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)sc2c1CCCC2

STK761943
Synonyms: (5Z)- 5- {[(4- bromophenyl)amino]methylidene}- 1- (3- chlorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Brc1ccc(cc1)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl

STK761944
Synonyms: (5Z)- 5- {[(5- chloro- 2- hydroxyphenyl)amino]methylidene}- 1- (4- methylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C/Nc2cc(Cl)ccc2O)/C1=O

STK676130
Synonyms: 2- [3,5- dimethyl- 1- (4- nitrophenyl)- 1H- pyrazol- 4- yl]- 5,8- dinitro- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: [O-][N+](=O)c1ccc(cc1)n1nc(c(c1C)n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)[N+](=O)[O-])[N+](=O)[O-])C

STK761946
Synonyms: 4- ({(Z)- [1- (3,4- dimethylphenyl)- 3- methyl- 5- oxo- 1,5- dihydro- 4H- pyrazol- 4- ylidene]methyl}amino)- N,N- dimethylbenzamide
Smiles: CN(C(=O)c1ccc(cc1)N/C=C\1/C(=NN(C1=O)c1ccc(c(c1)C)C)C)C

STK761947
Synonyms: N- [3- ({(Z)- [1- (4- fluorophenyl)- 3- methyl- 5- oxo- 1,5- dihydro- 4H- pyrazol- 4- ylidene]methyl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1cccc(c1)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)F)C

STK761948
Synonyms: propyl5- (5- bromo- 1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)- 2- chlorobenzoate
Smiles: CCCOC(=O)c1cc(ccc1Cl)n1c(=O)c2cccc3c2c(c1=O)cc(c3)Br

STK761952
Synonyms: N- [3- methyl- 4- (2- oxo- 2H- chromen- 3- yl)phenyl]- 2- phenylacetamide
Smiles: O=C(Cc1ccccc1)Nc1ccc(c(c1)C)c1cc2ccccc2oc1=O

STK761973
Synonyms: 3- chloro- 5- (3,4- dimethoxyphenyl)- N- (propan- 2- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: COc1cc(ccc1OC)c1cc(n2c(n1)c(Cl)c(n2)C(=O)NC(C)C)C(F)(F)F

STK761976
Synonyms: propan- 2- yl5- (4- methylphenyl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 3- carboxylate
Smiles: CC(OC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccc(cc1)C)C

STK676145
Synonyms: N- [3- (2,8,9- trioxa- 5- aza- 1- silabicyclo[3.3.3]undec- 1- yl)propyl]acetamide
Smiles: CC(=O)NCCC[Si]12OCCN(CCO1)CCO2

STK761980
Synonyms: 4- (2- methylphenyl)- 2,4- dihydro[1,2,4]triazolo[4,3- a]quinazoline- 1,5- dione
Smiles: O=c1n(c2ccccc2C)c2n[nH]c(=O)n2c2c1cccc2

STK761984
Synonyms: 4- phenyl- 3- [(2E)- 3- phenylprop- 2- enoyl]quinolin- 2(1H)- one
Smiles: O=C(c1c(=O)[nH]c2c(c1c1ccccc1)cccc2)/C=C/c1ccccc1

STK761985
Synonyms: 6- bromo- 3- [(2E)- 3- (4- methoxyphenyl)prop- 2- enoyl]- 4- phenylquinolin- 2(1H)- one
Smiles: COc1ccc(cc1)/C=C/C(=O)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Br

STK676148
Synonyms: diethyl2- {[(4- methylpiperazin- 1- yl)acetyl]amino}- 4,7- dihydrothieno[2,3- c]pyridine- 3,6(5H)- dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCN(CC2)C)sc2c1CCN(C2)C(=O)OCC

STK676149
Synonyms: 6- {(E)- 2- [4- (morpholin- 4- yl)- 3- nitrophenyl]ethenyl}- 5- nitropyrimidine- 2,4- diol
Smiles: Oc1nc(/C=C/c2ccc(c(c2)[N+](=O)[O-])N2CCOCC2)c(c(n1)O)[N+](=O)[O-]

STK761986
Synonyms: N- {1- [4- (diphenylmethyl)piperazin- 1- yl]- 2- methylpropan- 2- yl}benzenesulfonamide
Smiles: CC(NS(=O)(=O)c1ccccc1)(CN1CCN(CC1)C(c1ccccc1)c1ccccc1)C

STK761988
Synonyms: 4- (6- methyl- 1,3- benzothiazol- 2- yl)phenyl3- iodobenzoate
Smiles: Ic1cccc(c1)C(=O)Oc1ccc(cc1)c1sc2c(n1)ccc(c2)C

STK761993
Synonyms: N- [3- (1H- benzimidazol- 2- yl)- 4- chlorophenyl]- 3- iodobenzamide
Smiles: Ic1cccc(c1)C(=O)Nc1ccc(c(c1)c1nc2c([nH]1)cccc2)Cl

STK761995
Synonyms: 5- (4- chlorophenyl)- N- [2- (4- fluorophenyl)- 1,3- benzoxazol- 5- yl]furan- 2- carboxamide
Smiles: Fc1ccc(cc1)c1oc2c(n1)cc(cc2)NC(=O)c1ccc(o1)c1ccc(cc1)Cl

STK761997
Synonyms: 5- (4- chlorophenyl)- N- [2- (pyridin- 3- yl)- 1,3- benzoxazol- 5- yl]furan- 2- carboxamide
Smiles: Clc1ccc(cc1)c1ccc(o1)C(=O)Nc1ccc2c(c1)nc(o2)c1cccnc1

STK762006
Synonyms: N- benzyl- N- (pyridin- 2- yl)tricyclo[3.3.1.1~3,7~]decane- 1- carboxamide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)N(c1ccccn1)Cc1ccccc1

STK762011
Synonyms: 6- iodo- 3- (4- methoxyphenyl)- 2- methylquinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)n1c(C)nc2c(c1=O)cc(cc2)I

STK762014
Synonyms: 4- ethoxy- N- [3- methyl- 4- (2- oxo- 2H- chromen- 3- yl)phenyl]- 3- nitrobenzamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1ccc(c(c1)C)c1cc2ccccc2oc1=O

STK676154
Synonyms: 5- (3,4- dimethoxyphenyl)- 1,3- dithiane1,1,3,3- tetraoxide
Smiles: COc1cc(ccc1OC)C1CS(=O)(=O)CS(=O)(=O)C1

STK762024
Synonyms: (2E,5E)- 2,5- bis(4- methylbenzylidene)cyclopentanone
Smiles: O=C1/C(=C/c2ccc(cc2)C)/CC/C/1=C\c1ccc(cc1)C

STK762025
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 7- hydroxy- 6- propyl- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CCCc1cc2c(cc1O)oc(c(c2=O)c1nc2c(s1)cccc2)C(F)(F)F

STK762027
Synonyms: 4- (4- fluorophenyl)- 6- oxo- 2- (propylsulfanyl)- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: CCCSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)F

STK762029
Synonyms: propyl({3- cyano- 6- oxo- 4- [4- (propan- 2- yl)phenyl]- 1,4,5,6- tetrahydropyridin- 2- yl}sulfanyl)acetate
Smiles: CCCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)C(C)C

STK762035
Synonyms: N- [3- (diethylamino)propyl]- 5- (4- methylphenyl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 3- carboxamide
Smiles: CCN(CCCNC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccc(cc1)C)CC

STK676160
Synonyms: 2,6- dibromo- 4- (morpholin- 4- ylcarbonothioyl)phenyl4- methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1c(Br)cc(cc1Br)C(=S)N1CCOCC1

STK762038
Synonyms: 1- {2- [(2,6- dichlorophenyl)amino]- 4,5- dihydro- 1H- imidazol- 1- yl}ethanone
Smiles: CC(=O)N1CCN=C1Nc1c(Cl)cccc1Cl

STK762041
Synonyms: 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 8- [(2- methylpropyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(SCC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK762042
Synonyms: 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 8- [(3- methylbutyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(SCCC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK762052
Synonyms: N- [3- (3- bromophenyl)- 1- phenyl- 1H- pyrazol- 5- yl]acetamide
Smiles: CC(=O)Nc1cc(nn1c1ccccc1)c1cccc(c1)Br

STK762055
Synonyms: 1,1- dioxidotetrahydrothiophen- 3- ylphenylcarbamate
Smiles: O=C(Nc1ccccc1)OC1CCS(=O)(=O)C1

STK762057
Synonyms: (5Z)- 3- (4- methylphenyl)- 5- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 1,3- thiazolidine- 2,4- dione
Smiles: Cc1ccc(cc1)N1C(=O)S/C(=C/2\C(=O)Nc3c2cccc3)/C1=O

STK762059
Synonyms: 4- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)- N- (pyridin- 3- ylmethyl)butanamide
Smiles: O=C(NCc1cccnc1)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK676181
Synonyms: 2- {2- [4- (2,4- dinitrophenyl)piperazin- 1- yl]ethyl}- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: [O-][N+](=O)c1cc(ccc1N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)[N+](=O)[O-]

STK762063
Synonyms: (3Z)- 3- [3- (2,3- dimethylphenyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: S=C1S/C(=C/2\C(=O)Nc3c2cccc3)/C(=O)N1c1cccc(c1C)C

STK762064
Synonyms: (3Z)- 3- [3- (3,4- dimethylphenyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]- 1- methyl- 1,3- dihydro- 2H- indol- 2- one
Smiles: S=C1S/C(=C\2/c3ccccc3N(C2=O)C)/C(=O)N1c1ccc(c(c1)C)C

STK762065
Synonyms: N- (4- nitrophenyl)thiophene- 2- sulfonamide
Smiles: [O-][N+](=O)c1ccc(cc1)NS(=O)(=O)c1cccs1

STK762067
Synonyms: 2- (1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 9H- purin- 9- yl)acetohydrazide
Smiles: NNC(=O)Cn1cnc2c1n(C)c(=O)n(c2=O)C

STK762070
Synonyms: 6- (5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- ylamino)hexanoicacid
Smiles: OC(=O)CCCCCNc1ncnc2c1c1CCCCc1s2

STK762071
Synonyms: 1- (3,6- dichloro- 9H- carbazol- 9- yl)- 3- (3,5- diphenyl- 1H- pyrazol- 1- yl)propan- 2- ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)Cn1nc(cc1c1ccccc1)c1ccccc1

STK762072
Synonyms: 3- (2- nitro- 1- phenylethyl)- 1H- indole
Smiles: [O-][N+](=O)CC(c1c[nH]c2c1cccc2)c1ccccc1

STK676183
Synonyms: 1- (3,6- diiodo- 9H- carbazol- 9- yl)- 3- [(4- ethoxyphenyl)amino]propan- 2- ol
Smiles: CCOc1ccc(cc1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)I)I)O

STK676184
Synonyms: 1- (3,6- diiodo- 9H- carbazol- 9- yl)- 3- (naphthalen- 1- ylamino)propan- 2- ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)I)I)CNc1cccc2c1cccc2

STK676185
Synonyms: 1- (3,6- diiodo- 9H- carbazol- 9- yl)- 3- [(4- iodophenyl)amino]propan- 2- ol
Smiles: Ic1ccc(cc1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)I)I)O

STK762073
Synonyms: 1- (3,6- dibromo- 9H- carbazol- 9- yl)- 3- [(2,3- dimethylphenyl)amino]propan- 2- ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)CNc1cccc(c1C)C

STK762082
Synonyms: ethylN- {4- chloro- 6- [(4- iodophenyl)amino]- 1,3,5- triazin- 2- yl}glycinate
Smiles: CCOC(=O)CNc1nc(Nc2ccc(cc2)I)nc(n1)Cl

STK762083
Synonyms: 6- chloro- N- (furan- 2- ylmethyl)- N'- hexyl- 1,3,5- triazine- 2,4- diamine
Smiles: CCCCCCNc1nc(Cl)nc(n1)NCc1ccco1

STK762085
Synonyms: 6- (2- methylpropoxy)- 2,3,4,9- tetrahydro- 1H- carbazol- 1- one
Smiles: CC(COc1ccc2c(c1)c1CCCC(=O)c1[nH]2)C

STK762088
Synonyms: N- [5- (1H- benzimidazol- 2- yl)- 2- methylphenyl]- 4- methyl- 3- nitrobenzamide
Smiles: Cc1ccc(cc1NC(=O)c1ccc(c(c1)[N+](=O)[O-])C)c1nc2c([nH]1)cccc2

STK762096
Synonyms: N- (4- methylphenyl)- 1H- 1,2,4- triazole- 3- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1n[nH]cn1

STK762098
Synonyms: N- [3- (4- chlorophenyl)- 1- phenyl- 1H- pyrazol- 5- yl]acetamide
Smiles: CC(=O)Nc1cc(nn1c1ccccc1)c1ccc(cc1)Cl

STK762099
Synonyms: 1,1'- {4- [(4- bromophenyl)amino]- 6- hydroxy- 6- methyl- 2- (4- methylphenyl)cyclohex- 3- ene- 1,3- diyl}diethanone
Smiles: Cc1ccc(cc1)C1C(=C(Nc2ccc(cc2)Br)CC(C1C(=O)C)(C)O)C(=O)C

STK762100
Synonyms: 4- [(4- bromophenyl)carbonyl]- 3- hydroxy- 5- (4- methoxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)C1NC(=O)C(=C1C(=O)c1ccc(cc1)Br)O

STK762114
Synonyms: ethyl1- (4- chlorobenzyl)- 5- methyl- 1H- pyrazole- 4- carboxylate
Smiles: CCOC(=O)c1cnn(c1C)Cc1ccc(cc1)Cl

STK762128
Synonyms: 5- (6- amino- 9H- purin- 9- yl)- N- ethyl- 3,4- dihydroxytetrahydrofuran- 2- carboxamide(non- preferredname)
Smiles: CCNC(=O)C1OC(C(C1O)O)n1cnc2c1ncnc2N

STK762131
Synonyms: (4Z)- 4- {[5- (2- bromo- 5- nitrophenyl)furan- 2- yl]methylidene}- 5- methyl- 2- (4- methylphenyl)- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1ccc(cc1)N1N=C(/C(=C/c2ccc(o2)c2cc(ccc2Br)[N+](=O)[O-])/C1=O)C

STK762141
Synonyms: 4- {(4Z)- 4- [(5Z)- 3- ethyl- 5- (5- methoxy- 3- methyl- 1,3- benzothiazol- 2(3H)- ylidene)- 4- oxo- 1,3- thiazolidin- 2- ylidene]- 3- methyl- 5- oxo- 4,5- dihydro- 1H- pyrazol- 1- yl}benzoicacid
Smiles: COc1ccc2c(c1)n(C)/c(=c\1/s/c(=C\3/C(=NN(C3=O)c3ccc(cc3)C(=O)O)C)/n(c1=O)CC)/s2

STK762149
Synonyms: 2- (2- hydroxyethyl)- 6- (piperidin- 1- yl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: OCCn1c(=O)c2ccc(c3c2c(c1=O)ccc3)N1CCCCC1

STK762163
Synonyms: 6- acetyl- 2- (1,3,5- trimethyl- 1H- pyrazol- 4- yl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: CC(=O)c1ccc2c3c1cccc3c(=O)n(c2=O)c1c(C)nn(c1C)C

STK762186
Synonyms: 4- acetyl- 1- (4- fluorophenyl)- 3- hydroxy- 5- (4- methylphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C1C(=C(C(=O)N1c1ccc(cc1)F)O)C(=O)C

STK762190
Synonyms: 4- bromophenyl3- methyl- 1- phenyl- 1H- thieno[2,3- c]pyrazole- 5- carboxylate
Smiles: Brc1ccc(cc1)OC(=O)c1cc2c(s1)n(nc2C)c1ccccc1

STK762192
Synonyms: 4,8- dimethoxyfuro[2,3- b]quinolin- 7- ol
Smiles: COc1c(O)ccc2c1nc1occc1c2OC

STK762195
Synonyms: N- phenylazepane- 1- carboxamide
Smiles: O=C(N1CCCCCC1)Nc1ccccc1

STK762207
Synonyms: 7- methoxy- 5- methyl- 3- (4- methyl- 1,3- thiazol- 2- yl)- 4H- chromen- 4- one
Smiles: COc1cc(C)c2c(c1)occ(c2=O)c1scc(n1)C

STK762221
Synonyms: 6- [(3- phenoxybenzyl)sulfanyl]- 5- thioxo- 4,5- dihydro- 1,2,4- triazin- 3(2H)- one
Smiles: S=c1[nH]c(=O)[nH]nc1SCc1cccc(c1)Oc1ccccc1

STK762230
Synonyms: 6- bromo- 2- (1,3,5- trimethyl- 1H- pyrazol- 4- yl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Brc1ccc2c3c1cccc3c(=O)n(c2=O)c1c(C)nn(c1C)C

STK762231
Synonyms: 5- amino- 3- [(Z)- 1- cyano- 2- (5- methylfuran- 2- yl)ethenyl]- 1- phenyl- 1H- pyrazole- 4- carbonitrile
Smiles: N#C/C(=C\c1ccc(o1)C)/c1nn(c(c1C#N)N)c1ccccc1

STK762232
Synonyms: N- methyl- 5,7- dinitroquinolin- 8- amine
Smiles: CNc1c(cc(c2c1nccc2)[N+](=O)[O-])[N+](=O)[O-]

STK762248
Synonyms: propyl4- (5- bromo- 1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)benzoate
Smiles: CCCOC(=O)c1ccc(cc1)n1c(=O)c2cccc3c2c(c1=O)cc(c3)Br

STK762249
Synonyms: (4Z)- 4- {[(2,3- dichlorophenyl)amino]methylidene}- 5- methyl- 2- (2,4,6- trichlorophenyl)- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: Clc1cc(Cl)c(c(c1)Cl)N1N=C(/C(=C/Nc2cccc(c2Cl)Cl)/C1=O)C

STK762250
Synonyms: N- [(Z)- 1- (1H- benzimidazol- 2- yl)- 2- (4- methylphenyl)ethenyl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)/C=C(/c1nc2c([nH]1)cccc2)\NC(=O)c1ccc(cc1)C

STK762251
Synonyms: 4- [(1,1,1,3,3,3- hexafluoropropan- 2- yl)oxy]- 6- hydrazinyl- N- (2- nitrophenyl)- 1,3,5- triazin- 2- amine
Smiles: NNc1nc(nc(n1)OC(C(F)(F)F)C(F)(F)F)Nc1ccccc1[N+](=O)[O-]

STK762256
Synonyms: (4Z)- 4- {[(5- chloro- 2- methoxy- 4- nitrophenyl)amino]methylidene}- 2- (4- iodophenyl)- 5- methyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1cc([N+](=O)[O-])c(cc1N/C=C\1/C(=NN(C1=O)c1ccc(cc1)I)C)Cl

STK762257
Synonyms: (5Z)- 1- (3- chlorophenyl)- 5- [(pyridin- 2- ylamino)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Clc1cccc(c1)N1C(=O)NC(=O)/C(=C/Nc2ccccn2)/C1=O

STK762258
Synonyms: (4Z)- 4- {[(5- ethyl- 1,3,4- thiadiazol- 2- yl)amino]methylidene}- 2- (4- fluorophenyl)- 5- methyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: CCc1nnc(s1)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)F)C

STK762259
Synonyms: (4Z)- 2- (4- bromophenyl)- 4- {[(5- chloro- 2- methoxy- 4- nitrophenyl)amino]methylidene}- 5- methyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1cc([N+](=O)[O-])c(cc1N/C=C\1/C(=NN(C1=O)c1ccc(cc1)Br)C)Cl

STK676213
Synonyms: (4Z)- 5- methyl- 2- (4- methylphenyl)- 4- [(1H- tetrazol- 5- ylamino)methylidene]- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1ccc(cc1)N1N=C(/C(=C/Nc2nnn[nH]2)/C1=O)C

STK762261
Synonyms: (5Z)- 1- (3- chlorophenyl)- 5- ({[5- (2,4- dichlorophenyl)- 1,3,4- thiadiazol- 2- yl]amino}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Clc1ccc(c(c1)Cl)c1nnc(s1)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl

STK762262
Synonyms: 4- ({(Z)- [1- (4- chlorophenyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}amino)- N,N- dimethylbenzamide
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C/Nc2ccc(cc2)C(=O)N(C)C)/C1=O

STK762263
Synonyms: (4Z)- 4- {[(5- chloro- 2- methoxy- 4- nitrophenyl)amino]methylidene}- 2- (3- chlorophenyl)- 5- methyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1cc([N+](=O)[O-])c(cc1N/C=C\1/C(=NN(C1=O)c1cccc(c1)Cl)C)Cl

STK762264
Synonyms: 4- ({(Z)- [1- (4- bromophenyl)- 3- methyl- 5- oxo- 1,5- dihydro- 4H- pyrazol- 4- ylidene]methyl}amino)- 3- methoxyphenylthiocyanate
Smiles: N#CSc1ccc(c(c1)OC)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)Br)C

STK762266
Synonyms: (5Z)- 5- {[(5- chloro- 2- hydroxyphenyl)amino]methylidene}- 1- (3- chlorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Clc1ccc(c(c1)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl)O

STK762268
Synonyms: diethyl5- ({(Z)- [1- (2,4- dimethylphenyl)- 3- methyl- 5- oxo- 1,5- dihydro- 4H- pyrazol- 4- ylidene]methyl}amino)- 3- methylthiophene- 2,4- dicarboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=NN(C2=O)c2ccc(cc2C)C)C)sc(c1C)C(=O)OCC

STK762275
Synonyms: N- [3- (1H- benzimidazol- 2- yl)- 4- chlorophenyl]- 3- chlorobenzamide
Smiles: Clc1cccc(c1)C(=O)Nc1ccc(c(c1)c1nc2c([nH]1)cccc2)Cl

STK762279
Synonyms: 5- (4- methylphenyl)- 7- (trifluoromethyl)- N- [3- (trifluoromethyl)phenyl]pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: Cc1ccc(cc1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)Nc1cccc(c1)C(F)(F)F

STK762280
Synonyms: [5- (4- methylphenyl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidin- 2- yl](4- methylpiperidin- 1- yl)methanone
Smiles: CC1CCN(CC1)C(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(cc1)C

STK762305
Synonyms: 15H- indeno[1',2':5,6]pyrazino[2,3- b]phenazin- 15- one
Smiles: O=C1c2ccccc2c2c1nc1cc3nc4ccccc4nc3cc1n2

STK762307
Synonyms: N- (3- chlorophenyl)- N'- (2,5- dimethoxyphenyl)[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: COc1ccc(c(c1)Nc1nc2nonc2nc1Nc1cccc(c1)Cl)OC

STK762311
Synonyms: (6,7- dimethoxy- 3,3- dimethyl- 3,4- dihydroisoquinolin- 1- yl)acetonitrile
Smiles: N#CCC1=NC(C)(C)Cc2c1cc(OC)c(c2)OC

STK676233
Synonyms: (4Z)- 2- (3- bromophenyl)- 5- methyl- 4- [(5- nitrofuran- 2- yl)methylidene]- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: Brc1cccc(c1)N1N=C(/C(=C/c2ccc(o2)[N+](=O)[O-])/C1=O)C

STK676234
Synonyms: 4- fluoro- 6- phenoxypyrimidin- 2- amine
Smiles: Fc1cc(Oc2ccccc2)nc(n1)N

STK676237
Synonyms: 1- (8- methyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)- 3- (2- methylphenoxy)propan- 2- ol
Smiles: OC(CN1CCn2c3C1CCCc3c1c2ccc(c1)C)COc1ccccc1C

STK762320
Synonyms: 3,5- bis(phenylamino)- 4H- 1,2,6- thiadiazin- 4- one
Smiles: O=c1c(nsnc1Nc1ccccc1)Nc1ccccc1

STK676247
Synonyms: 7- nitro- 5- (pyrrolidin- 1- ylmethyl)quinolin- 8- ol
Smiles: Oc1c2ncccc2c(cc1[N+](=O)[O-])CN1CCCC1

STK762326
Synonyms: 1- [4- (6- nitro- 1,3- benzothiazol- 2- yl)piperazin- 1- yl]- 2- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]ethanone
Smiles: O=C(N1CCN(CC1)c1nc2c(s1)cc(cc2)[N+](=O)[O-])CSc1nnnn1c1ccccc1

STK676250
Synonyms: N- (4- chlorophenyl)- N'- (2,3- dimethylphenyl)[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: Clc1ccc(cc1)Nc1nc2nonc2nc1Nc1cccc(c1C)C

STK762332
Synonyms: (5E)- 5- (4- ethoxy- 3- methoxybenzylidene)- 3- (piperidin- 1- ylmethyl)- 1,3- thiazolidine- 2,4- dione
Smiles: CCOc1ccc(cc1OC)/C=C\1/SC(=O)N(C1=O)CN1CCCCC1

STK762334
Synonyms: N- [2- (biphenyl- 2- yloxy)- 5- (trifluoromethyl)phenyl]- 2- hydroxybenzamide
Smiles: O=C(c1ccccc1O)Nc1cc(ccc1Oc1ccccc1c1ccccc1)C(F)(F)F

STK762336
Synonyms: 1,4- dimethyl- 9H- thioxanthen- 9- one
Smiles: Cc1ccc(c2c1sc1ccccc1c2=O)C

STK762338
Synonyms: 8- chloro- 1,3- dimethyl- 7- [2- oxo- 2- (piperidin- 1- yl)ethyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=C(N1CCCCC1)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

STK762345
Synonyms: 3'- (3- bromo- 4- methylphenyl)- 4'H- spiro[indole- 3,2'- [1,3]thiazolidine]- 2,4'(1H)- dione
Smiles: O=C1CSC2(N1c1ccc(c(c1)Br)C)C(=O)Nc1c2cccc1

STK676258
Synonyms: 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(3H)- one
Smiles: Cc1cc(=O)n2c(n1)[nH]cn2

STK676260
Synonyms: N- (2- fluorophenyl)- N'- (4- methylphenyl)[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: Cc1ccc(cc1)Nc1nc2nonc2nc1Nc1ccccc1F

STK676261
Synonyms: N- (4- chlorophenyl)- N'- methyl[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: CNc1nc2nonc2nc1Nc1ccc(cc1)Cl

STK676266
Synonyms: 2,3,6,7- tetramethylquinoxaline
Smiles: Cc1cc2nc(C)c(nc2cc1C)C

STK762353
Synonyms: 2- benzyl- 6,7- dimethoxy- 1- methylisoquinolin- 3(2H)- one
Smiles: COc1cc2c(cc1OC)cc(=O)n(c2C)Cc1ccccc1

STK676267
Synonyms: 4- (4- bromophenyl)- 1- chloro- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinoline- 8- carboxylicacid
Smiles: Brc1ccc(cc1)C1Nc2ccc(cc2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])C(=O)O

STK762356
Synonyms: 3'- (3,4- dimethylphenyl)- 1- [(4- phenylpiperazin- 1- yl)methyl]- 4'H- spiro[indole- 3,2'- [1,3]thiazolidine]- 2,4'(1H)- dione
Smiles: O=C1CSC2(N1c1ccc(c(c1)C)C)C(=O)N(c1c2cccc1)CN1CCN(CC1)c1ccccc1

STK762363
Synonyms: methyl[(7- ethyl- 1,3- dimethyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc2c(n1CC)c(=O)n(c(=O)n2C)C

STK676276
Synonyms: 4- {5- [(2,4,6- trimethylbenzyl)sulfanyl]- 1H- tetrazol- 1- yl}benzoicacid
Smiles: Cc1cc(C)c(c(c1)C)CSc1nnnn1c1ccc(cc1)C(=O)O

STK676282
Synonyms: 12- {[(2,5- dimethoxy- 2,5- dihydrofuran- 2- yl)methyl]carbamoyl}- 9,10- dihydro- 9,10- ethanoanthracene- 11- carboxylicacid
Smiles: COC1C=CC(O1)(OC)CNC(=O)C1C2c3ccccc3C(C1C(=O)O)c1c2cccc1

STK676286
Synonyms: (1E)- 2- (bicyclo[2.2.1]hept- 5- en- 2- yl)- 1- [3- (morpholin- 4- yl)- 5- nitro- 1- benzofuran- 2(3H)- ylidene]propan- 2- ol
Smiles: [O-][N+](=O)c1ccc2c(c1)C(N1CCOCC1)/C(=C\C(C1CC3CC1C=C3)(O)C)/O2

STK762373
Synonyms: 5- acetyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: O=C1CCN(c2c(N1)cccc2)C(=O)C

STK762374
Synonyms: 5- acetyl- 4- methyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: O=C1CC(C)N(c2c(N1)cccc2)C(=O)C

STK676289
Synonyms: 5- acetyl- 3- methyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: O=C1Nc2ccccc2N(CC1C)C(=O)C

STK676290
Synonyms: 5- propanoyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: CCC(=O)N1CCC(=O)Nc2c1cccc2

STK762378
Synonyms: 5- [(2- chlorophenyl)carbonyl]- 4- methyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: O=C1Nc2ccccc2N(C(C1)C)C(=O)c1ccccc1Cl

STK762380
Synonyms: 3- methyl- 1,5- dipropanoyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: CCC(=O)N1CC(C)C(=O)N(c2c1cccc2)C(=O)CC

STK762382
Synonyms: 5- acetyl- 1- benzyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: O=C1CCN(c2c(N1Cc1ccccc1)cccc2)C(=O)C

STK762383
Synonyms: 5- acetyl- 1- (3- methylbutyl)- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: CC(CCN1C(=O)CCN(c2c1cccc2)C(=O)C)C

STK762384
Synonyms: 1- benzyl- 3- methyl- 5- propanoyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: CCC(=O)N1CC(C)C(=O)N(c2c1cccc2)Cc1ccccc1

STK676299
Synonyms: 5- acetyl- 1- benzyl- 4- phenyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: CC(=O)N1c2ccccc2N(C(=O)CC1c1ccccc1)Cc1ccccc1

STK762386
Synonyms: 5- benzyl- 4- oxo- 2,3,4,5- tetrahydro- 1H- 1,5- benzodiazepine- 1- carbaldehyde
Smiles: O=CN1CCC(=O)N(c2c1cccc2)Cc1ccccc1

STK762388
Synonyms: 5- benzyl- 2- methyl- 4- oxo- 2,3,4,5- tetrahydro- 1H- 1,5- benzodiazepine- 1- carbaldehyde
Smiles: O=CN1C(C)CC(=O)N(c2c1cccc2)Cc1ccccc1

STK676302
Synonyms: 1- (prop- 2- en- 1- yl)- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: C=CCN1C(=O)CCNc2c1cccc2

STK676303
Synonyms: 1- methyl- 4- phenyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: O=C1CC(Nc2c(N1C)cccc2)c1ccccc1

STK676304
Synonyms: 1,4,5- trimethyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: CC1CC(=O)N(c2c(N1C)cccc2)C

STK676305
Synonyms: 5- ethyl- 1- methyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: CCN1CCC(=O)N(c2c1cccc2)C

STK762392
Synonyms: 1,4- dimethyl- 7- nitro- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: CC1CC(=O)N(c2c(N1)cc(cc2)[N+](=O)[O-])C

STK676308
Synonyms: 4,5- dimethyl- 7- nitro- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: O=C1CC(C)N(c2c(N1)ccc(c2)[N+](=O)[O-])C

STK676309
Synonyms: 1- benzyl- N- cyclohexyl- 2- methyl- 2,3- dihydro- 1H- 1,5- benzodiazepin- 4- amine
Smiles: CC1CC(=Nc2c(N1Cc1ccccc1)cccc2)NC1CCCCC1

STK762394
Synonyms: N'- (1,2- dimethyl- 2,3- dihydro- 1H- 1,5- benzodiazepin- 4- yl)benzohydrazide
Smiles: O=C(c1ccccc1)NNC1=Nc2ccccc2N(C(C1)C)C

STK762395
Synonyms: 8- amino- 2- methyl- 4- oxo- 2,3,4,5- tetrahydro- 1H- 1,5- benzodiazepine- 1- carbaldehyde
Smiles: O=CN1C(C)CC(=O)Nc2c1cc(N)cc2

STK676312
Synonyms: 1,5- diacetyl- 3- methyl- 1,3,4,5- tetrahydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: CC1CN(C(=O)C)c2c(N(C1=O)C(=O)C)cccc2

STK762400
Synonyms: 1- (3,7- dimethyl- 1,4- dioxidoquinoxalin- 2- yl)ethanone
Smiles: Cc1ccc2c(c1)[n+]([O-])c(c([n+]2[O-])C)C(=O)C

STK762401
Synonyms: N- (2- fluorophenyl)- N'- phenyl[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: Fc1ccccc1Nc1nc2nonc2nc1Nc1ccccc1

STK676313
Synonyms: ethyl4- {[6- (methylamino)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2nonc2nc1NC

STK762415
Synonyms: 5- (dibenzo[b,d]thiophen- 3- yl)- 2- (4- fluorophenyl)- 4- phenyl- 1H- imidazole
Smiles: Fc1ccc(cc1)c1nc(c([nH]1)c1ccc2c(c1)sc1c2cccc1)c1ccccc1

STK676318
Synonyms: 4- (dimethylamino)- 6- methoxy- 1,3,5- triazine- 2- carbonitrile
Smiles: COc1nc(C#N)nc(n1)N(C)C

STK762416
Synonyms: [8- chloro- 4- (cyclohex- 3- en- 1- yl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinolin- 6- yl](phenyl)methanone
Smiles: Clc1cc2C3C=CCC3C(Nc2c(c1)C(=O)c1ccccc1)C1CCC=CC1

STK762417
Synonyms: 1- chloro- 4- (2- fluorophenyl)- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,11c- hexahydro- 1H- benzo[f]cyclopenta[c]quinoline
Smiles: Fc1ccccc1C1Nc2ccc3c(c2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])cccc3

STK762425
Synonyms: 8- chloro- 9- nitro- 4- phenyl- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinolin- 6- ol
Smiles: Oc1cc(Cl)c(c2c1NC(c1ccccc1)C1C2C=CC1)[N+](=O)[O-]

STK676323
Synonyms: 1- chloro- 4- (2- fluorophenyl)- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinoline- 8- carboxylicacid
Smiles: ClC1C(Sc2ccccc2[N+](=O)[O-])CC2C1c1cc(ccc1NC2c1ccccc1F)C(=O)O

STK762426
Synonyms: 2- (1,3- benzodioxol- 5- yl)- 4- (naphthalen- 1- yl)- 5- phenyl- 1H- imidazole
Smiles: c1ccc(cc1)c1[nH]c(nc1c1cccc2c1cccc2)c1ccc2c(c1)OCO2

STK676326
Synonyms: 6- hydroxy- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinoline- 4- carboxylicacid
Smiles: OC(=O)C1Nc2c(O)cccc2C2C1CC=C2

STK762428
Synonyms: 8- chloro- 4- (cyclohex- 3- en- 1- yl)- 9- nitro- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinolin- 6- ol
Smiles: Oc1cc(Cl)c(c2c1NC(C1CCC=CC1)C1C2C=CC1)[N+](=O)[O-]

STK676328
Synonyms: 7- (2- fluorophenyl)- 3b,6,6a,7,9,9a,10,12a- octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1- ij]quinoline- 2- carboxylicacid
Smiles: OC(=O)c1cc2C3C=CCC3C(N3c2c(c1)C1C=CCC1C3)c1ccccc1F

STK676330
Synonyms: 1- [(4- phenylpiperazin- 1- yl)methyl]- 3'- [3- (trifluoromethyl)phenyl]- 4'H- spiro[indole- 3,2'- [1,3]thiazolidine]- 2,4'(1H)- dione
Smiles: O=C1CSC2(N1c1cccc(c1)C(F)(F)F)C(=O)N(c1c2cccc1)CN1CCN(CC1)c1ccccc1

STK762430
Synonyms: [2- amino- 1- (4- phenyl- 1,3- thiazol- 2- yl)indolizin- 3- yl](phenyl)methanone
Smiles: O=C(c1n2ccccc2c(c1N)c1scc(n1)c1ccccc1)c1ccccc1

STK762432
Synonyms: (2E)- 2- (hydroxyimino)- N'- [(3Z)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]ethanehydrazide
Smiles: O/N=C/C(=O)N/N=C/1\C(=O)Nc2c1cccc2

STK676331
Synonyms: 2- [(3,4- dimethoxybenzyl)sulfanyl]- 3- phenylquinazolin- 4(3H)- one
Smiles: COc1ccc(cc1OC)CSc1nc2ccccc2c(=O)n1c1ccccc1

STK762444
Synonyms: (3Z)- 3- [2- (5- methylfuran- 2- yl)- 2- oxoethylidene]- 3,4- dihydroquinoxalin- 2(1H)- one
Smiles: Cc1ccc(o1)C(=O)/C=c/1\[nH]c2ccccc2[nH]c1=O

STK762461
Synonyms: ethyl3- amino- 1- (1,3- benzodioxol- 5- yl)- 1H- benzo[f]chromene- 2- carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccc3c(c1)OCO3)c1ccccc1cc2

STK762462
Synonyms: (2E)- 2- [(3- phenylbicyclo[2.2.1]hepta- 2,5- dien- 2- yl)methylidene]hydrazinecarbothioamide
Smiles: NC(=S)N/N=C/C1=C(C2CC1C=C2)c1ccccc1

STK676343
Synonyms: 4- [(pyridin- 3- ylmethyl)amino]- 1- oxaspiro[4.5]dec- 3- en- 2- one
Smiles: O=C1C=C(C2(O1)CCCCC2)NCc1cccnc1

STK676352
Synonyms: 6- {3- hydroxy- 5- (4- methylphenyl)- 4- [(4- methylphenyl)carbonyl]- 2- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)c1ccc(cc1)C

STK676359
Synonyms: 4- [(2- hydroxyethyl)(methyl)amino]- 1- oxaspiro[4.5]dec- 3- en- 2- one
Smiles: OCCN(C1=CC(=O)OC21CCCCC2)C

STK762496
Synonyms: 3- {[2- (4- chlorophenyl)- 1,3- thiazolidin- 3- yl]carbonyl}- 2H- chromen- 2- one
Smiles: Clc1ccc(cc1)C1SCCN1C(=O)c1cc2ccccc2oc1=O

STK762498
Synonyms: (3- methyl- 1- phenyl- 1H- thieno[2,3- c]pyrazol- 5- yl)(3- methyl- 1H- pyrazol- 1- yl)methanone
Smiles: Cc1ccn(n1)C(=O)c1cc2c(s1)n(nc2C)c1ccccc1

STK762501
Synonyms: propan- 2- yl3- methyl- 1- phenyl- 1H- thieno[2,3- c]pyrazole- 5- carboxylate
Smiles: CC(OC(=O)c1cc2c(s1)n(nc2C)c1ccccc1)C

STK676361
Synonyms: N- [(3- cyano- 1- methyl- 1H- indol- 2- yl)methyl]- 2- (morpholin- 4- yl)- N- phenylacetamide
Smiles: N#Cc1c(CN(c2ccccc2)C(=O)CN2CCOCC2)n(c2c1cccc2)C

STK676362
Synonyms: 4- [4- (2- hydroxyethyl)piperazin- 1- yl]- 1- oxaspiro[4.5]dec- 3- en- 2- one
Smiles: OCCN1CCN(CC1)C1=CC(=O)OC21CCCCC2

STK676366
Synonyms: (4E)- 2- (4- bromophenyl)- 4- {[(5- ethyl- 1,3,4- thiadiazol- 2- yl)amino]methylidene}- 5- methyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: CCc1nnc(s1)N/C=C/1\C(=NN(C1=O)c1ccc(cc1)Br)C

STK762514
Synonyms: 3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 1- (pyridin- 2- yl)- 5- (pyridin- 3- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccnc1)c1ccccn1

STK762518
Synonyms: 4- (6- amino- 5- cyano- 3- methyl- 1,4- dihydropyrano[2,3- c]pyrazol- 4- yl)- 2- methoxyphenylmorpholine- 4- carboxylate
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC(=O)N1CCOCC1)c(C)n[nH]2

STK676374
Synonyms: ethylN- (6- ethoxy- 1,3- benzothiazol- 2- yl)- 3,3,3- trifluoro- 2- (propanoylamino)alaninate
Smiles: CCOc1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(=O)OCC)NC(=O)CC

STK762524
Synonyms: 1- [1- (4- bromophenyl)- 6,8- diphenyl- 4- thia- 1,2,6,7- tetraazaspiro[4.5]deca- 2,7- dien- 3- yl]ethanone
Smiles: Brc1ccc(cc1)N1N=C(SC21CCC(=NN2c1ccccc1)c1ccccc1)C(=O)C

STK762530
Synonyms: N'- {(Z)- [1- (2,6- dichlorobenzyl)- 3- phenyl- 1H- pyrazol- 4- yl]methylidene}- 2- methylfuran- 3- carbohydrazide
Smiles: Clc1cccc(c1Cn1nc(c(c1)/C=N\NC(=O)c1ccoc1C)c1ccccc1)Cl

STK676376
Synonyms: N'- {(E)- [3- (3,4- dihydroquinolin- 1(2H)- ylmethyl)- 4- methoxyphenyl]methylidene}- 4- iodo- 1- methyl- 1H- pyrazole- 3- carbohydrazide
Smiles: COc1ccc(cc1CN1CCCc2c1cccc2)/C=N/NC(=O)c1nn(cc1I)C

STK762531
Synonyms: 2- chloro- 4- nitro- N- [4- (piperidin- 1- ylcarbonyl)phenyl]benzamide
Smiles: O=C(c1ccc(cc1Cl)[N+](=O)[O-])Nc1ccc(cc1)C(=O)N1CCCCC1

STK676377
Synonyms: 2- oxo- 2- {[4- (trifluoromethoxy)phenyl]amino}ethyl2- methylfuran- 3- carboxylate
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)COC(=O)c1ccoc1C

STK676379
Synonyms: 3',5'- diphenyl- 3H,3'H- spiro[1,3- benzothiazole- 2,2'- [1,3,4]thiadiazole]
Smiles: c1ccc(cc1)C1=NN(C2(S1)Sc1c(N2)cccc1)c1ccccc1

STK762535
Synonyms: 3- methyl- 5- oxo- 4- propylcyclohexane- 1,1,2,2- tetracarbonitrile
Smiles: CCCC1C(=O)CC(C(C1C)(C#N)C#N)(C#N)C#N

STK762561
Synonyms: 8- (4- methylphenyl)- 8,10,11,12- tetrahydrobenzo[a][4,7]phenanthrolin- 9(7H)- one
Smiles: Cc1ccc(cc1)C1Nc2ccc3c(c2C2=C1C(=O)CCC2)cccn3

STK676387
Synonyms: 2- (benzylsulfonyl)- 4,6- dimethoxybenzonitrile
Smiles: COc1cc(OC)c(c(c1)S(=O)(=O)Cc1ccccc1)C#N

STK676389
Synonyms: (2E,4E)- 5- (furan- 2- yl)penta- 2,4- dienoicacid
Smiles: OC(=O)/C=C/C=C/c1ccco1

STK762564
Synonyms: 3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 1,2,4- oxadiazol- 5- amine
Smiles: Nc1onc(n1)c1nonc1N

STK762566
Synonyms: 4,4'- (propane- 2,2- diyldisulfanediyl)bis(2,6- di- tert- butylphenol)
Smiles: CC(Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)(Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C

STK676391
Synonyms: 6- amino- 2- bromo- 3- methylbenzoicacid
Smiles: OC(=O)c1c(N)ccc(c1Br)C

STK676392
Synonyms: methyl2,3,4- tri- O- acetyl- 6- O- tritylhexopyranoside
Smiles: COC1OC(COC(c2ccccc2)(c2ccccc2)c2ccccc2)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C

STK762568
Synonyms: 6,8- dioxabicyclo[3.2.1]octane- 2,3,4- triyltriacetate(non- preferredname)
Smiles: CC(=O)OC1C(OC(=O)C)C2COC(C1OC(=O)C)O2

STK676393
Synonyms: methyl4,6- bis- O- [(4- methylphenyl)sulfonyl]- 2,3- bis- O- (phenoxycarbonyl)hexopyranoside
Smiles: COC1OC(COS(=O)(=O)c2ccc(cc2)C)C(C(C1OC(=O)Oc1ccccc1)OC(=O)Oc1ccccc1)OS(=O)(=O)c1ccc(cc1)C

STK676397
Synonyms: 3- (dodecylsulfanyl)propanoicacid
Smiles: CCCCCCCCCCCCSCCC(=O)O

STK676398
Synonyms: 5- (octylsulfanyl)pentanoicacid
Smiles: CCCCCCCCSCCCCC(=O)O

STK762569
Synonyms: 2,2'- sulfinyldiethanol
Smiles: OCCS(=O)CCO

STK676399
Synonyms: 1- [(2- chloroethyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCCl

STK762570
Synonyms: 4- [(2- amino- 4- methyl- 1,3- thiazol- 5- yl)methyl]phenol
Smiles: Oc1ccc(cc1)Cc1sc(nc1C)N

STK762571
Synonyms: 3,3- bis(4- methylphenyl)- 2- benzofuran- 1(3H)- one
Smiles: Cc1ccc(cc1)C1(OC(=O)c2c1cccc2)c1ccc(cc1)C

STK676401
Synonyms: ethene- 1,1- diylbis(phosphonicacid)
Smiles: C=C(P(=O)(O)O)P(=O)(O)O

STK762572
Synonyms: methyl2H- tetrazol- 2- ylacetate
Smiles: COC(=O)Cn1nncn1

STK676405
Synonyms: 2- amino- 6- chlorobenzoicacid
Smiles: OC(=O)c1c(N)cccc1Cl

STK676406
Synonyms: 2- (acetylamino)- 6- chlorobenzoicacid
Smiles: CC(=O)Nc1cccc(c1C(=O)O)Cl

STK676407
Synonyms: ethyl2- amino- 5- ethyl- 4- phenylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(N)sc(c1c1ccccc1)CC

STK762592
Synonyms: 4,4- dihydroxy- 2- (4- methoxyphenyl)- 5- [(4- methylphenyl)carbonyl]- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)N1N=C(C(C1=O)(O)O)C(=O)c1ccc(cc1)C

STK676410
Synonyms: methyl6- tert- butyl- 2- ({[(4- methyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2nncn2C)sc2c1CCC(C2)C(C)(C)C

STK676412
Synonyms: 3- chloro- 2- oxo- N- phenylpropanamide
Smiles: ClCC(=O)C(=O)Nc1ccccc1

STK762624
Synonyms: 2- amino- 1- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 6- methyl- 4,4- bis(trifluoromethyl)- 1,4- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)N1C(=CC(C(=C1N)C#N)(C(F)(F)F)C(F)(F)F)C

STK676420
Synonyms: 1,8- bis(2,3,5,6- tetrafluoropyridin- 4- yl)- 1,4,8,11- tetraazacyclotetradecane- 5,12- dione
Smiles: O=C1NCCN(CCC(=O)NCCN(CC1)c1c(F)c(F)nc(c1F)F)c1c(F)c(F)nc(c1F)F

STK676422
Synonyms: 4- acetyl- 3- hydroxy- 5- (3- nitrophenyl)- 1- [2- (piperazin- 1- yl)ethyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CCN1CCNCC1

STK762637
Synonyms: 2- [2- (4- amino- 1,2,5- oxadiazol- 3- yl)- 1H- benzimidazol- 1- yl]- 1- (morpholin- 4- yl)ethanone
Smiles: O=C(N1CCOCC1)Cn1c(nc2c1cccc2)c1nonc1N

STK762638
Synonyms: 2- amino- 5- (propan- 2- yl)[1,2,4]triazolo[1,5- a]pyrimidin- 7(3H)- one
Smiles: CC(c1cc(=O)n2c(n1)[nH]c(n2)N)C

STK676431
Synonyms: 6- (4- benzylpiperazin- 1- yl)- N- (2- fluorophenyl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: Fc1ccccc1Nc1nc2nonc2nc1N1CCN(CC1)Cc1ccccc1

STK676433
Synonyms: N- cyclopentyl- 6- (morpholin- 4- yl)- N'- (propan- 2- yl)- 1,3,5- triazine- 2,4- diamine
Smiles: CC(Nc1nc(NC2CCCC2)nc(n1)N1CCOCC1)C

STK676434
Synonyms: 4,4,6a,6b- tetramethyl- 3- (4- methylphenyl)hexahydro- 3H- 1- oxa- 2a,3- diazacyclopenta[cd]pentalen- 2- one
Smiles: Cc1ccc(cc1)N1N2C(=O)OC3(C2(C(C1(C)C)CC3)C)C

STK676435
Synonyms: N- [2- (4,5- dihydro- 1,3- thiazol- 2- ylamino)- 1,1,1,3,3,3- hexafluoropropan- 2- yl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)NC(C(F)(F)F)(C(F)(F)F)NC1=NCCS1

STK676438
Synonyms: N- (3,4- dimethylphenyl)- N'- (propan- 2- yl)[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: CC(Nc1nc2nonc2nc1Nc1ccc(c(c1)C)C)C

STK676440
Synonyms: ethyl6- amino- 4- (3- iodophenyl)- 3- propyl- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1cccc(c1)I)c(CCC)n[nH]2

STK676441
Synonyms: 5- [4- (5- amino- 1,3,4- thiadiazol- 2- yl)phenyl]- 2,2- dimethyl- 2,3,5,6- tetrahydrobenzo[a]phenanthridin- 4(1H)- one
Smiles: Nc1nnc(s1)c1ccc(cc1)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3

STK762668
Synonyms: 2- (2- amino- 1,3- thiazol- 4- yl)- N'- [(3E)- 2- oxo- 1- (prop- 2- en- 1- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]acetohydrazide
Smiles: C=CCN1C(=O)/C(=N/NC(=O)Cc2csc(n2)N)/c2c1cccc2

STK762669
Synonyms: 2,4,7- trimethylbenzo[b][1,8]naphthyridin- 5(10H)- one
Smiles: Cc1ccc2c(c1)c(=O)c1c([nH]2)nc(cc1C)C

STK676450
Synonyms: 4- {2- [(2- oxo- 1- oxaspiro[4.5]dec- 3- en- 4- yl)amino]ethyl}benzenesulfonamide
Smiles: O=C1C=C(C2(O1)CCCCC2)NCCc1ccc(cc1)S(=O)(=O)N

STK762676
Synonyms: tert- butyl4- (4- chlorophenyl)- 5- cyano- 2- methyl- 6- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCc2cccc3c2cccc3)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK762680
Synonyms: tert- butyl6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (4- chlorophenyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK762681
Synonyms: 2- {[5- acetyl- 4- (2- chlorophenyl)- 3- cyano- 6- methyl- 1,4- dihydropyridin- 2- yl]sulfanyl}- N- (2,4- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C(C1c1ccccc1Cl)C(=O)C)C

STK762682
Synonyms: tert- butyl4- (4- chlorophenyl)- 5- cyano- 2- methyl- 6- ({2- [(2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK762683
Synonyms: 5- cyano- 2- methyl- N- (2- methylphenyl)- 6- ({2- [(2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK762684
Synonyms: tert- butyl4- (4- chlorophenyl)- 5- cyano- 6- ({2- [(2,5- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK762687
Synonyms: 6- bromo- 4- (2,5- dimethoxyphenyl)- 3,4- dihydrobenzo[h]quinolin- 2(1H)- one
Smiles: COc1ccc(cc1C1CC(=O)Nc2c1cc(Br)c1c2cccc1)OC

STK762691
Synonyms: tert- butyl4- (4- chlorophenyl)- 5- cyano- 6- ({2- [(2,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK676455
Synonyms: [(3E)- 3- (2- acetylhydrazinylidene)- 2- oxo- 2,3- dihydro- 1H- indol- 1- yl]aceticacid
Smiles: CC(=O)N/N=C\1/C(=O)N(c2c1cccc2)CC(=O)O

STK762694
Synonyms: N- (4- chlorophenyl)- 5,6- dimethylthieno[2,3- d]pyrimidin- 4- amine
Smiles: Clc1ccc(cc1)Nc1ncnc2c1c(C)c(s2)C

STK762695
Synonyms: 5- iodo- 2,4- dimethyl- 1H- pyrrole- 3- carbaldehyde
Smiles: O=Cc1c(C)[nH]c(c1C)I

STK762700
Synonyms: 5,7- dimethyl- 1,4- dihydroquinoxaline- 2,3- dione
Smiles: Cc1cc(C)c2c(c1)[nH]c(=O)c(=O)[nH]2

STK762709
Synonyms: 2- {[2- nitro- 4- (trifluoromethyl)phenyl]sulfanyl}- N- [2- (pyrrolidin- 1- yl)- 5- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cc(ccc1N1CCCC1)C(F)(F)F)CSc1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK762710
Synonyms: N- [2- methoxy- 5- (trifluoromethyl)phenyl]- 2- {[2- nitro- 4- (trifluoromethyl)phenyl]sulfanyl}acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1ccc(cc1[N+](=O)[O-])C(F)(F)F)C(F)(F)F

STK762718
Synonyms: 2- (4- methoxyphenyl)- N'- methyl- N',2,2- triphenylacetohydrazide
Smiles: COc1ccc(cc1)C(c1ccccc1)(c1ccccc1)C(=O)NN(c1ccccc1)C

STK676468
Synonyms: 3,4- bis[(4- methylphenyl)sulfonyl]- 1,2,5- oxadiazole2- oxide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1[n+]([O-])onc1S(=O)(=O)c1ccc(cc1)C

STK762730
Synonyms: 4- methyl- 2H- furo[2,3- h]chromene- 2,9(8H)- dione
Smiles: O=c1cc(C)c2c(o1)c1C(=O)COc1cc2

STK676473
Synonyms: 1,1',1'',1'''- (ethane- 1,2- diyldinitrilo)tetrakis(3- phenoxypropan- 2- ol)
Smiles: OC(CN(CC(COc1ccccc1)O)CCN(CC(COc1ccccc1)O)CC(COc1ccccc1)O)COc1ccccc1

STK676474
Synonyms: 6- hydrazinyl- 3- (trifluoromethyl)[1,2,4]triazolo[3,4- a]phthalazine
Smiles: NNc1nn2c(c3c1cccc3)nnc2C(F)(F)F

STK762736
Synonyms: 5- hydroxy- 3- (4- methoxyphenyl)- 8- methyl- 7- oxo- 6- azabicyclo[3.2.1]octane- 1,2,2- tricarbonitrile
Smiles: N#CC1(C#N)C(CC2(C(C1(C#N)C(=O)N2)C)O)c1ccc(cc1)OC

STK762737
Synonyms: 3- [(2,2- dichloro- 1- methylcyclopropyl)methyl]- 1- phenylimidazolidine- 2,4- dione
Smiles: O=C1CN(C(=O)N1CC1(C)CC1(Cl)Cl)c1ccccc1

STK762739
Synonyms: 4- amino- N'- (pyridin- 3- ylcarbonyl)- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: O=C(c1cccnc1)N/N=C(/c1nonc1N)\N

STK676477
Synonyms: 4- (chloromethyl)- 2,2- dimethyl- 1,2,3,4- tetrahydrobenzo[f]isoquinoline
Smiles: ClCC1NC(C)(C)Cc2c1ccc1c2cccc1

STK762741
Synonyms: 4- oxo- 6- (propan- 2- yl)- 3- propylcyclohexane- 1,1,2,2- tetracarbonitrile
Smiles: CCCC1C(=O)CC(C(C1(C#N)C#N)(C#N)C#N)C(C)C

STK676480
Synonyms: 4- [(5E)- 5- (furan- 2- ylmethylidene)- 2,4,6- trioxotetrahydropyrimidin- 1(2H)- yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccco2)/C1=O

STK762746
Synonyms: 2- [(1H- 1,2,4- triazol- 3- ylsulfanyl)methyl]pyridine
Smiles: c1ccc(nc1)CSc1n[nH]cn1

STK676482
Synonyms: N- [3- (dicyanomethylidene)- 3H- indol- 2- yl]- 4- methylbenzenesulfonamide
Smiles: N#CC(=C1C(=Nc2c1cccc2)NS(=O)(=O)c1ccc(cc1)C)C#N

STK762749
Synonyms: 4- (naphthalen- 2- ylmethoxy)benzaldehyde
Smiles: O=Cc1ccc(cc1)OCc1ccc2c(c1)cccc2

STK762750
Synonyms: N- (2- {[2- (4- methylphenyl)- 1,3- dioxo- 2,3- dihydro- 1H- benzo[de]isoquinolin- 6- yl]sulfanyl}phenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(=O)c2ccc(c3c2c(c1=O)ccc3)Sc1ccccc1NC(=O)C

STK676491
Synonyms: 5,7- dimethyltetrahydro- 1H- imidazo[4,5- e][1,2,4]triazine- 3,6(2H,4H)- dione
Smiles: O=C1NNC2C(N1)N(C)C(=O)N2C

STK762759
Synonyms: 2,2',5,5'- tetraphenyl- 2H,2'H- 3,3'- bipyrazole
Smiles: c1ccc(cc1)n1nc(cc1c1cc(nn1c1ccccc1)c1ccccc1)c1ccccc1

STK676495
Synonyms: (2E,3Z,2'E,3'Z)- 3,3'- {benzene- 1,3- diylbis[(E)methylylidene(1Z,2E)hydrazine- 2,1- diylidene]}bis(N- hydroxybutan- 2- imine)
Smiles: O/N=C(/C(=N\N=C\c1cccc(c1)/C=N/N=C(\C(=N\O)\C)/C)/C)\C

STK676498
Synonyms: 5- (3- methoxyphenyl)- 3- phenyl- 2- sulfanylthieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: COc1cccc(c1)c1csc2c1c(=O)n(c(n2)S)c1ccccc1

STK676501
Synonyms: 5- ethyl- 3- (2- hydroxyphenyl)- 1- [2- (methylsulfanyl)ethyl]- 4,6- dioxooctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: CSCCC1(NC(C2C1C(=O)N(C2=O)CC)c1ccccc1O)C(=O)O

STK676504
Synonyms: 2- (diethoxyphosphoryl)phenylN- (cyclohex- 3- en- 1- ylmethyl)- N- (tetrahydrofuran- 2- ylmethyl)glycinate
Smiles: CCOP(=O)(c1ccccc1OC(=O)CN(CC1CCC=CC1)CC1CCCO1)OCC

STK676505
Synonyms: N- (4- amino- 1,2,5- oxadiazol- 3- yl)- 2- (1- azabicyclo[2.2.2]oct- 3- yloxy)acetamide
Smiles: O=C(Nc1nonc1N)COC1CN2CCC1CC2

STK762765
Synonyms: 2- (1H- imidazol- 2- ylcarbonyl)- N- (pyridin- 3- ylmethyl)benzamide
Smiles: O=C(c1ccccc1C(=O)c1ncc[nH]1)NCc1cccnc1

STK676506
Synonyms: 6- (2- chlorophenyl)- 4- (2,4- dihydroxyphenyl)- 4- (4- methoxyphenyl)tetrahydropyrimidine- 2(1H)- thione
Smiles: COc1ccc(cc1)C1(NC(=S)NC(C1)c1ccccc1Cl)c1ccc(cc1O)O

STK762774
Synonyms: 3,5- dibromo- N- nitropyridin- 2- amine
Smiles: [O-][N+](=O)Nc1ncc(cc1Br)Br

STK676508
Synonyms: 2- (difluoromethyl)- 5- (methoxycarbonyl)- 4- (2- methylpropyl)- 6- (trifluoromethyl)pyridine- 3- carboxylicacid
Smiles: COC(=O)c1c(CC(C)C)c(C(=O)O)c(nc1C(F)(F)F)C(F)F

STK762776
Synonyms: 1,3- dinitrodibenzo[b,f][1,4]oxazepin- 11(10H)- one
Smiles: O=C1Nc2ccccc2Oc2c1c(cc(c2)[N+](=O)[O-])[N+](=O)[O-]

STK676510
Synonyms: 2,4- diazido- 6- (benzylsulfanyl)benzonitrile
Smiles: [N-]=[N+]=Nc1cc(SCc2ccccc2)c(c(c1)N=[N+]=[N-])C#N

STK676514
Synonyms: 1- phenyl- 1H- 1,2,3- triazole- 4- carboxylicacid
Smiles: OC(=O)c1nnn(c1)c1ccccc1

STK762782
Synonyms: N- benzyl- 6- hydrazinyl- N'- phenyl- 1,3,5- triazine- 2,4- diamine
Smiles: NNc1nc(NCc2ccccc2)nc(n1)Nc1ccccc1

STK676518
Synonyms: 8- methyl- 7H- imidazo[4,5- e][1,2,5]oxadiazolo[3,4- g][2,1,3]benzoxadiazole3,6- dioxide(non- preferredname)
Smiles: Cc1nc2c([nH]1)c1[n+]([O-])onc1c1c2no[n+]1[O-]

STK762786
Synonyms: N,N'- di(tricyclo[3.3.1.1~3,7~]dec- 2- yl)[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: C1C2CC3C(C1CC(C2)C3)Nc1nc2nonc2nc1NC1C2CC3CC1CC(C2)C3

STK762789
Synonyms: ethyl(2E)- 5- (2,4- dimethoxyphenyl)- 2- [(1,5- dimethyl- 1H- pyrazol- 4- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1OC)OC)c(=O)/c(=C\c1cnn(c1C)C)/s2

STK762793
Synonyms: 2- {[2- (morpholin- 4- yl)- 2- oxoethyl]sulfanyl}- 4,6- diphenylpyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCOCC2)nc(cc1c1ccccc1)c1ccccc1

STK762795
Synonyms: 3- (6- amino- 5- cyano- 3- methyl- 1,4- dihydropyrano[2,3- c]pyrazol- 4- yl)phenylmorpholine- 4- carboxylate
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)OC(=O)N1CCOCC1)c(C)n[nH]2

STK762801
Synonyms: 4- [2- amino- 2- (4- methyl- 2,6- dioxocyclohexylidene)ethyl]piperidine- 2,6- dione
Smiles: CC1CC(=O)/C(=C(\CC2CC(=O)NC(=O)C2)/N)/C(=O)C1

STK676522
Synonyms: 2- [2- (2H- benzotriazol- 2- yl)- 4- methylphenoxy]- 5- (morpholin- 4- ylsulfonyl)benzamide
Smiles: Cc1ccc(c(c1)n1nc2c(n1)cccc2)Oc1ccc(cc1C(=O)N)S(=O)(=O)N1CCOCC1

STK762820
Synonyms: methyl5- cyano- 4- (2- ethoxyphenyl)- 2- oxo- 6- sulfanyl- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: CCOc1ccccc1C1C(C(=O)OC)C(=O)NC(=C1C#N)S

STK762821
Synonyms: 4- amino- 6- methyl- 1H- pyrrolo[3,4- c]pyridine- 1,3(2H)- dione
Smiles: Cc1nc(N)c2c(c1)C(=O)NC2=O

STK676536
Synonyms: 2- (6- chloroimidazo[1,2- a]pyridin- 2- yl)phenol
Smiles: Clc1ccc2n(c1)cc(n2)c1ccccc1O

STK676538
Synonyms: 4- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)benzyl]morpholine
Smiles: O1CCN(CC1)Cc1ccc(cc1)C12CC3CC(C2)CC(C1)C3

STK762838
Synonyms: ethyl2- [(3- cyano- 4- ethyl- 5- methylthiophen- 2- yl)amino]- N- (dimethylcarbamoyl)- 3,3,3- trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc(c(c1C#N)CC)C)NC(=O)N(C)C

STK676542
Synonyms: (2E)- 3- (2- methoxyphenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoicacid
Smiles: COc1ccccc1/C=C(\C(=O)O)/NC(=O)c1ccccc1

STK676544
Synonyms: 1- (1,3- benzodioxol- 5- ylmethyl)- 3- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]pyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1Cc1ccc2c(c1)OCO2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK676545
Synonyms: 2- oxo- 2,3- dihydro- 1H- indole- 3- carbaldehyde
Smiles: O=CC1C(=O)Nc2c1cccc2

STK762852
Synonyms: 2- {[2- (morpholin- 4- yl)- 2- oxoethyl]sulfanyl}- 6- (thiophen- 2- yl)- 4- (trifluoromethyl)pyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCOCC2)nc(cc1C(F)(F)F)c1cccs1

STK762859
Synonyms: 2- [(7- amino- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 3- yl)sulfanyl]- N- (5- methylpyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccc(cn1)C)CSc1nnc2n1ncn2N

STK762862
Synonyms: methyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- tert- butyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: COC(=O)c1nnn(c1C(C)(C)C)c1nonc1N

STK676549
Synonyms: 6'- amino- 3'- ethyl- 1'H- spiro[fluorene- 9,4'- pyrano[2,3- c]pyrazole]- 5'- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31c1ccccc1c1c3cccc1)c(CC)n[nH]2

STK762870
Synonyms: methyl3,4,5- trimethoxy- 2,6- dinitrobenzoate
Smiles: COC(=O)c1c([N+](=O)[O-])c(OC)c(c(c1[N+](=O)[O-])OC)OC

STK762873
Synonyms: 4,4- dimethyl- 3- [(1E)- prop- 1- en- 1- yl]- 2- oxaspiro[5.5]undecane- 1,5- dione
Smiles: C/C=C/C1OC(=O)C2(C(=O)C1(C)C)CCCCC2

STK762876
Synonyms: 16- (3,4- dichlorophenyl)- 15- oxadispiro[5.1.5.3]hexadecane- 7,14- dione
Smiles: Clc1cc(ccc1Cl)C1OC(=O)C2(C(=O)C31CCCCC3)CCCCC2

STK676559
Synonyms: 2,2'- (1,3- diethyl- 2- oxoimidazolidine- 4,5- diyl)dihydrazinecarbothioamide
Smiles: CCN1C(NNC(=S)N)C(N(C1=O)CC)NNC(=S)N

STK762882
Synonyms: 6- (4- amino- 1,2,5- oxadiazol- 3- yl)- 1,3,5- triazine- 2,4- diamine
Smiles: Nc1nc(N)nc(n1)c1nonc1N

STK762895
Synonyms: 5- (1,3- benzodioxol- 5- yl)- 1- phenyl- 3- (phenylamino)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C1C(=CC(N1c1ccccc1)c1ccc2c(c1)OCO2)Nc1ccccc1

STK762900
Synonyms: 3'- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 5'- methyl- 4'H- spiro[indole- 3,2'- [1,3]thiazolidine]- 2,4'(1H)- dione
Smiles: CC1SC2(N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C)C(=O)Nc1c2cccc1

STK762901
Synonyms: ethyl1- {2- [(4- chlorophenyl)carbonyl]- 4- nitrophenyl}piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1ccc(cc1C(=O)c1ccc(cc1)Cl)[N+](=O)[O-]

STK676576
Synonyms: [(3Z)- 3- (6,7- dimethyl- 3- oxo[1,3]thiazolo[3,2- a]benzimidazol- 2(3H)- ylidene)- 2- oxo- 2,3- dihydro- 1H- indol- 1- yl]aceticacid
Smiles: OC(=O)CN1c2ccccc2/C(=c\2/sc3n(c2=O)c2c(n3)cc(c(c2)C)C)/C1=O

STK762909
Synonyms: methyl1- [4- (ethoxycarbonyl)phenyl]- 2,4- dihydroxy- 5- oxo- 3- (phenylcarbonyl)- 2,5- dihydro- 1H- pyrrole- 2- carboxylate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1(O)C(=O)OC)C(=O)c1ccccc1)O

STK762910
Synonyms: 4- (benzyloxy)- N- nitro- N- [2- (pyridin- 4- yl)ethyl]aniline
Smiles: [O-][N+](=O)N(c1ccc(cc1)OCc1ccccc1)CCc1ccncc1

STK762912
Synonyms: 3- amino- 1- benzofuran- 2- carboxamide
Smiles: NC(=O)c1oc2c(c1N)cccc2

STK676585
Synonyms: 4- hydroxy- 4- methyl- 3- (2,2,6,6- tetramethylpiperidin- 4- yl)- 1- oxa- 3- azaspiro[4.5]decan- 2- one
Smiles: O=C1OC2(C(N1C1CC(C)(C)NC(C1)(C)C)(C)O)CCCCC2

STK762919
Synonyms: 4- (bicyclo[2.2.1]hept- 5- en- 2- yl)- 4- oxobutane- 1,1,2,2- tetracarbonitrile
Smiles: N#CC(C(C#N)C#N)(CC(=O)C1CC2CC1C=C2)C#N

STK762924
Synonyms: N- (4- ethylphenyl)- 4- methylquinolin- 2- amine
Smiles: CCc1ccc(cc1)Nc1cc(C)c2c(n1)cccc2

STK676587
Synonyms: dimethyl(3- chloro- 6- nitro- 1,2- benzothiazol- 4- yl)phosphoramidate
Smiles: COP(=O)(Nc1cc(cc2c1c(Cl)ns2)[N+](=O)[O-])OC

STK762934
Synonyms: N- benzyl- 2- (benzylsulfanyl)- 4- nitrobenzamide
Smiles: O=C(c1ccc(cc1SCc1ccccc1)[N+](=O)[O-])NCc1ccccc1

STK762935
Synonyms: 5- hydroxy- 7- oxo- 3- phenyl- 4- propyl- 6- azabicyclo[3.2.1]octane- 1,2,2- tricarbonitrile
Smiles: CCCC1C(c2ccccc2)C(C#N)(C#N)C2(CC1(O)NC2=O)C#N

STK676590
Synonyms: 4- [(diethylcarbamothioyl)amino]benzoicacid
Smiles: CCN(C(=S)Nc1ccc(cc1)C(=O)O)CC

STK676591
Synonyms: (2E)- 2- ({4- [chloro(difluoro)methoxy]phenyl}imino)- 3- methyl- 4- oxo- 1,3- thiazinane- 6- carboxylicacid
Smiles: CN1C(=O)CC(S/C/1=N/c1ccc(cc1)OC(Cl)(F)F)C(=O)O

STK762939
Synonyms: N- {4- [(4,6- dimethylpyrimidin- 2- yl)sulfamoyl]phenyl}- 2- (4H- 1,2,4- triazol- 3- ylsulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C)CSc1nnc[nH]1

STK762940
Synonyms: 7- methyl- 3- (thiophen- 2- ylcarbonyl)- 4H- chromen- 4- one
Smiles: Cc1ccc2c(c1)occ(c2=O)C(=O)c1cccs1

STK762947
Synonyms: 4- acetyl- 1- (1,3- benzothiazol- 2- yl)- 5- (2,4- dimethoxyphenyl)- 3- hydroxy- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(c(c1)OC)C1N(c2nc3c(s2)cccc3)C(=O)C(=C1C(=O)C)O

STK762953
Synonyms: ethyl1- [(5- methyl- 2'- oxo- 5- phenylspiro[1,3- dioxane- 2,3'- indol]- 1'(2'H)- yl)methyl]piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CN1c2ccccc2C2(C1=O)OCC(CO2)(C)c1ccccc1

STK676596
Synonyms: 2- (2,4- difluorophenoxy)- N'- [(E)- {4- ethoxy- 3- [(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)methyl]phenyl}methylidene]acetohydrazide
Smiles: CCOc1ccc(cc1CN1CC2CC(C1)c1n(C2)c(=O)ccc1)/C=N/NC(=O)COc1ccc(cc1F)F

STK762958
Synonyms: N- (4- chlorophenyl)- 3- (5- methylfuran- 2- yl)propanamide
Smiles: O=C(Nc1ccc(cc1)Cl)CCc1ccc(o1)C

STK762959
Synonyms: (2E)- 2- (3- nitrobenzylidene)imidazo[1,2- b][1,2]benzothiazol- 3(2H)- one5,5- dioxide
Smiles: O=C1/C(=C\c2cccc(c2)[N+](=O)[O-])/N=C2N1S(=O)(=O)c1c2cccc1

STK676603
Synonyms: N',N',5- trimethylfuran- 2- carbohydrazide
Smiles: CN(NC(=O)c1ccc(o1)C)C

STK762965
Synonyms: 1,3- diacetyl- 5- bromo- 1,3- dihydro- 2H- benzimidazol- 2- one
Smiles: Brc1ccc2c(c1)n(C(=O)C)c(=O)n2C(=O)C

STK762968
Synonyms: (9Z)- 9- benzylidene- 4- methyl- 2H- furo[2,3- h]chromene- 2,8(9H)- dione
Smiles: O=c1cc(C)c2c(o1)c1c(cc2)OC(=O)/C/1=C\c1ccccc1

STK762973
Synonyms: 5- methyl- 2- (1H- tetrazol- 1- yl)pyridine
Smiles: Cc1ccc(nc1)n1cnnn1

STK762974
Synonyms: 6- amino- 3- methyl- 4- (3- phenoxyphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)Oc1ccccc1)c(C)n[nH]2

STK762975
Synonyms: 2- {[2- (3,4- dihydroxyphenyl)- 2- oxoethyl]sulfanyl}- 4- (methoxymethyl)- 6- methylpyridine- 3- carbonitrile
Smiles: COCc1cc(C)nc(c1C#N)SCC(=O)c1ccc(c(c1)O)O

STK762979
Synonyms: 2- (2- imino- 3- methyl- 2,3- dihydro- 1H- benzimidazol- 1- yl)- 1- phenylethanone
Smiles: O=C(c1ccccc1)Cn1c2ccccc2n(c1=N)C

STK762980
Synonyms: 2- (2- imino- 3- methyl- 2,3- dihydro- 1H- benzimidazol- 1- yl)- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethanone
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)Cn1c(=N)n(c2c1cccc2)C

STK762982
Synonyms: 2- (3- ethyl- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl)- 1- phenylethanone
Smiles: CCn1c2ccccc2n(c1=N)CC(=O)c1ccccc1

STK762983
Synonyms: 1- (4- chlorophenyl)- 2- (3- ethyl- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl)ethanone
Smiles: CCn1c(=N)n(c2c1cccc2)CC(=O)c1ccc(cc1)Cl

STK762984
Synonyms: 2- (3- ethyl- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl)- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethanone
Smiles: CCn1c(=N)n(c2c1cccc2)CC(=O)C12CC3CC(C2)CC(C1)C3

STK762986
Synonyms: 1- methyl- 4- nitro- 5- phenoxy- 1H- imidazole
Smiles: Cn1cnc(c1Oc1ccccc1)[N+](=O)[O-]

STK676614
Synonyms: 7H- indolo[2',3':5,6][1,2,4]triazino[2,3- a]benzimidazol- 7- ylaceticacid
Smiles: OC(=O)Cn1c2ccccc2c2c1nc1nc3c(n1n2)cccc3

STK676615
Synonyms: ethyl1- (2- hydroxyethyl)- 4- (4- methoxyphenyl)- 6- methyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: OCCN1C(=O)NC(C(=C1C)C(=O)OCC)c1ccc(cc1)OC

STK762994
Synonyms: 2,6- diphenylimidazo[1,2- b][1,2,4]triazine
Smiles: c1ccc(cc1)c1cn2c(n1)ncc(n2)c1ccccc1

STK762997
Synonyms: 2,6,7- triphenylimidazo[1,2- b][1,2,4]triazine
Smiles: c1ccc(cc1)c1cnc2n(n1)c(c1ccccc1)c(n2)c1ccccc1

STK763005
Synonyms: (1Z)- 1- (3- ethoxy- 4- hydroxybenzylidene)- 6- methyl- 4- thioxo- 4,5- dihydrofuro[3,4- c]pyridin- 3(1H)- one
Smiles: CCOc1cc(ccc1O)/C=C/1\OC(=O)c2c1cc(C)[nH]c2=S

STK676617
Synonyms: 4,6- diazido- 2- methyl- 1,2- benzothiazol- 3(2H)- one1- oxide
Smiles: [N-]=[N+]=Nc1cc(N=[N+]=[N-])c2c(c1)s(=O)n(c2=O)C

STK763008
Synonyms: N- [4- (methoxymethyl)- 6- methyl- 2- (phenylcarbonyl)thieno[2,3- b]pyridin- 3- yl]furan- 2- carboxamide
Smiles: COCc1cc(C)nc2c1c(NC(=O)c1ccco1)c(s2)C(=O)c1ccccc1

STK763010
Synonyms: 6- nitro- 1- phenyl- 1H- indazole
Smiles: [O-][N+](=O)c1ccc2c(c1)n(nc2)c1ccccc1

STK676618
Synonyms: 1- (2,4- dinitrophenyl)- 6- nitro- 1H- indazole
Smiles: [O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])n1ncc2c1cc(cc2)[N+](=O)[O-]

STK763012
Synonyms: 1- (4- methoxyphenyl)- 6- nitro- 1H- indazole
Smiles: COc1ccc(cc1)n1ncc2c1cc(cc2)[N+](=O)[O-]

STK763014
Synonyms: 4- hydrazinyl- 2- methyl- 6- nitro- 1,2- benzothiazol- 3(2H)- one1- oxide
Smiles: NNc1cc(cc2c1c(=O)n(s2=O)C)[N+](=O)[O-]

STK763016
Synonyms: 4- nitro- N- phenyl- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]cc1[N+](=O)[O-])Nc1ccccc1

STK763017
Synonyms: 4- nitro- N- [4- (trifluoromethoxy)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]cc1[N+](=O)[O-])Nc1ccc(cc1)OC(F)(F)F

STK676621
Synonyms: 4- (acetylamino)- 1,2,5- oxadiazole- 3- carboxylicacid
Smiles: CC(=O)Nc1nonc1C(=O)O

STK763018
Synonyms: 3- (2- chlorophenyl)- 5- methyl- N- [4- (trifluoromethoxy)phenyl]- 1,2- oxazole- 4- carboxamide
Smiles: O=C(c1c(C)onc1c1ccccc1Cl)Nc1ccc(cc1)OC(F)(F)F

STK763027
Synonyms: N- cyclopropyl- 2- {[6- (5- nitro- 1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 1,3- benzothiazol- 2- yl]sulfanyl}acetamide
Smiles: O=C(NC1CC1)CSc1sc2c(n1)ccc(c2)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-]

STK763034
Synonyms: 2,4- dichloro- N- [5- (1H- indol- 3- ylmethyl)- 1,3,4- thiadiazol- 2- yl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)Nc1nnc(s1)Cc1c[nH]c2c1cccc2

STK763040
Synonyms: 2,2'- (1,2,4- thiadiazole- 3,5- diyldisulfanediyl)bis[N- (3- methylphenyl)acetamide]
Smiles: O=C(Nc1cccc(c1)C)CSc1snc(n1)SCC(=O)Nc1cccc(c1)C

STK763055
Synonyms: 3- amino- N- (2,3- dimethylphenyl)- 6,7- dihydro- 5H- cyclopenta[b]thieno[3,2- e]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)CCC1)Nc1cccc(c1C)C

STK763063
Synonyms: 6- ethyl- N,N- dimethyl- 5- phenylthieno[2,3- d]pyrimidin- 4- amine
Smiles: CCc1sc2c(c1c1ccccc1)c(ncn2)N(C)C

STK763064
Synonyms: N- (4- chloro- 2,5- dimethoxyphenyl)- 6- (2- methylpiperidin- 1- yl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: COc1cc(Cl)c(cc1Nc1nc2nonc2nc1N1CCCCC1C)OC

STK763065
Synonyms: 1- hydroxy- 3- (methoxymethyl)pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: COCc1cc(O)n2c(c1C#N)nc1c2cccc1

STK763067
Synonyms: 4- [1- (4- tert- butylbenzyl)- 1H- benzimidazol- 2- yl]- 1,2,5- oxadiazol- 3- amine
Smiles: Nc1nonc1c1nc2c(n1Cc1ccc(cc1)C(C)(C)C)cccc2

STK763068
Synonyms: 8- chloro- 1,3- dimethyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

STK763071
Synonyms: 2- (4- carboxyphenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: OC(=O)C1CSC(N1)c1ccc(cc1)C(=O)O

STK676645
Synonyms: 2- (4- methoxy- 3- methylphenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: COc1ccc(cc1C)C1SCC(N1)C(=O)O

STK763073
Synonyms: (2E)- 2- [4- (dimethylamino)benzylidene]- 6,7- dihydroxy- 1- benzofuran- 3(2H)- one
Smiles: O=C1/C(=C\c2ccc(cc2)N(C)C)/Oc2c1ccc(c2O)O

STK676646
Synonyms: 7H- imidazo[4,5- e][1,2,5]oxadiazolo[3,4- g][2,1,3]benzoxadiazole3,6- dioxide(non- preferredname)
Smiles: [O-][n+]1onc2c1c1[nH]cnc1c1c2[n+]([O-])on1

STK763084
Synonyms: 2,6- dichloro- N- (4- chlorophenyl)- 4- methyl- 5- nitropyridine- 3- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])Cl

STK763085
Synonyms: 2,6- dichloro- N- [(3,4- dichlorophenyl)carbamoyl]- 4- methyl- 5- nitropyridine- 3- carboxamide
Smiles: O=C(NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])Cl)Nc1ccc(c(c1)Cl)Cl

STK676652
Synonyms: 4,6- dimethyl- 1- (4- methylphenyl)- 2- oxo- 1,2- dihydropyridine- 3- carboxylicacid
Smiles: Cc1ccc(cc1)n1c(C)cc(c(c1=O)C(=O)O)C

STK676653
Synonyms: 2- (4- chloro- 2- methylphenoxy)- 4,6- dimethylpyridine- 3- carboxamide
Smiles: Clc1ccc(c(c1)C)Oc1nc(C)cc(c1C(=O)N)C

STK763091
Synonyms: 2,6- dichloro- N- [(4- methoxy- 6- methylpyrimidin- 2- yl)carbamoyl]- 4- methylpyridine- 3- sulfonamide
Smiles: COc1nc(nc(c1)C)NC(=O)NS(=O)(=O)c1c(C)cc(nc1Cl)Cl

STK676654
Synonyms: 5- chloro- 2,4- dimethoxypyridine- 3- carboxamide
Smiles: COc1ncc(c(c1C(=O)N)OC)Cl

STK676656
Synonyms: N- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazole- 3- sulfonamide
Smiles: C=CCNS(=O)(=O)c1[nH]cnn1

STK763095
Synonyms: 5,7- dimethyl- N- (2- methylphenyl)[1,2,4]triazolo[1,5- a]pyrimidine- 2- sulfonamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)S(=O)(=O)Nc1ccccc1C

STK763096
Synonyms: N- (2- chlorophenyl)- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- sulfonamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)S(=O)(=O)Nc1ccccc1Cl

STK676658
Synonyms: N- butyl- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- sulfonamide
Smiles: CCCCNS(=O)(=O)c1nn2c(n1)nc(cc2C)C

STK763097
Synonyms: 1- (4- chlorophenyl)- 3- [1- (4,6- dimethoxy- 1,3,5- triazin- 2- yl)- 1H- 1,2,4- triazol- 3- yl]urea
Smiles: COc1nc(OC)nc(n1)n1cnc(n1)NC(=O)Nc1ccc(cc1)Cl

STK763100
Synonyms: N- (2- cyano- 3- methylbutan- 2- yl)- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- sulfonamide
Smiles: N#CC(C(C)C)(NS(=O)(=O)c1nn2c(n1)nc(cc2C)C)C

STK676659
Synonyms: 1- (4,6- dimethoxy- 1,3,5- triazin- 2- yl)- 1H- 1,2,4- triazole- 3- sulfonamide
Smiles: COc1nc(OC)nc(n1)n1cnc(n1)S(=O)(=O)N

STK763102
Synonyms: 2- (4- chlorophenoxy)- N- (2- cyano- 3- methylbutan- 2- yl)pyridine- 3- carboxamide
Smiles: N#CC(C(C)C)(NC(=O)c1cccnc1Oc1ccc(cc1)Cl)C

STK763104
Synonyms: 2- (4- chlorophenoxy)- N- (2,5- dichlorophenyl)pyridine- 3- carboxamide
Smiles: Clc1ccc(cc1)Oc1ncccc1C(=O)Nc1cc(Cl)ccc1Cl

STK763105
Synonyms: 6- phenoxy- 1,3,5- triazine- 2,4- diamine
Smiles: Nc1nc(Oc2ccccc2)nc(n1)N

STK676664
Synonyms: (2E)- 1- (4- chlorophenyl)- 2- (4- nitrobenzylidene)hydrazine
Smiles: Clc1ccc(cc1)N/N=C/c1ccc(cc1)[N+](=O)[O-]

STK763114
Synonyms: (3Z)- 3- [(4- chlorophenyl)imino]- 1- (3,4- dihydroisoquinolin- 2(1H)- ylmethyl)- 1,3- dihydro- 2H- indol- 2- one
Smiles: Clc1ccc(cc1)/N=C/1\C(=O)N(c2c1cccc2)CN1CCc2c(C1)cccc2

STK763120
Synonyms: 2- methoxy- 4,6- di(morpholin- 4- yl)- 1,3,5- triazine
Smiles: COc1nc(nc(n1)N1CCOCC1)N1CCOCC1

STK763121
Synonyms: 2- ethoxy- 4,6- di(morpholin- 4- yl)- 1,3,5- triazine
Smiles: CCOc1nc(nc(n1)N1CCOCC1)N1CCOCC1

STK763123
Synonyms: 5- chloro- 2- (4- fluorophenoxy)- 4,6- dimethylpyridine- 3- carbonitrile
Smiles: N#Cc1c(Oc2ccc(cc2)F)nc(c(c1C)Cl)C

STK676669
Synonyms: 4- (dimethylamino)- 2- methyl- 1- phenylbutan- 2- ol
Smiles: CN(CCC(Cc1ccccc1)(O)C)C

STK763130
Synonyms: 2,3- dihydro- 1H- benzo[f]thiochromen- 1- one
Smiles: O=C1CCSc2c1c1ccccc1cc2

STK763132
Synonyms: (3E)- N- (4- bromophenyl)- 3- (2- {[(2- methylphenyl)amino](oxo)acetyl}hydrazinylidene)butanamide
Smiles: C/C(=N\NC(=O)C(=O)Nc1ccccc1C)/CC(=O)Nc1ccc(cc1)Br

STK676672
Synonyms: N- [(5- methylfuran- 2- yl)carbonyl]tryptophan
Smiles: OC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)c1ccc(o1)C

STK763138
Synonyms: 4- nitro- N- (3- nitrophenyl)- 1H- pyrazole- 5- carboxamide
Smiles: [O-][N+](=O)c1cccc(c1)NC(=O)c1[nH]ncc1[N+](=O)[O-]

STK763139
Synonyms: N- [4- (trifluoromethoxy)phenyl]- 4- (trifluoromethyl)benzamide
Smiles: O=C(c1ccc(cc1)C(F)(F)F)Nc1ccc(cc1)OC(F)(F)F

STK676673
Synonyms: methyl4- (acetylamino)- 1,2,5- oxadiazole- 3- carboxylate
Smiles: COC(=O)c1nonc1NC(=O)C

STK676674
Synonyms: 4- (propanoylamino)- 1,2,5- oxadiazole- 3- carboxylicacid
Smiles: CCC(=O)Nc1nonc1C(=O)O

STK763140
Synonyms: N- (2- methoxyphenyl)- 4- nitro- 1H- pyrazole- 3- carboxamide
Smiles: COc1ccccc1NC(=O)c1n[nH]cc1[N+](=O)[O-]

STK676676
Synonyms: N- (1,3- benzodioxol- 5- yl)- 4,6- di(piperidin- 1- yl)- 1,3,5- triazin- 2- amine
Smiles: C1CCN(CC1)c1nc(Nc2ccc3c(c2)OCO3)nc(n1)N1CCCCC1

STK676677
Synonyms: 4- [(Z)- (4- hydroxy- 1,2,5- oxadiazol- 3- yl)- NNO- azoxy]- 1,2,5- oxadiazol- 3- ol
Smiles: Oc1nonc1/N=[N+](/c1nonc1O)\[O-]

STK676679
Synonyms: 6- methyl- 2,4- dioxo- N- (pyridin- 2- yl)- 1,2,3,4- tetrahydropyrimidine- 5- sulfonamide
Smiles: Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)Nc1ccccn1

STK763143
Synonyms: N,N'- bis(furan- 2- ylmethyl)[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: c1coc(c1)CNc1nc2nonc2nc1NCc1ccco1

STK676682
Synonyms: (2E)- 4- (4- chlorophenyl)- 2- [2- (2,4- dinitrophenyl)hydrazinylidene]- 4- oxobutanoicacid
Smiles: Clc1ccc(cc1)C(=O)C/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C(=O)O

STK676685
Synonyms: 6- (piperidin- 1- yl)- 3H- dibenzo[de,h]cinnoline- 3,7(2H)- dione
Smiles: O=c1[nH]nc2c3c1ccc(c3c(=O)c1c2cccc1)N1CCCCC1

STK763160
Synonyms: (5E)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]- 1- (3- methoxyphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cccc(c1)N1C(=O)NC(=O)/C(=C\C=C\c2ccco2)/C1=O

STK676696
Synonyms: [7- (morpholin- 4- ylcarbonyl)- 1,5- dinitro- 3- azabicyclo[3.3.1]non- 6- en- 3- yl]aceticacid
Smiles: OC(=O)CN1CC2(CC(=CC(C1)(C2)[N+](=O)[O-])C(=O)N1CCOCC1)[N+](=O)[O-]

STK676697
Synonyms: (7- methoxy- 1,5- dinitro- 3- azabicyclo[3.3.1]non- 6- en- 3- yl)aceticacid
Smiles: COC1=CC2(CC(C1)(CN(C2)CC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

STK676698
Synonyms: N,N- dimethyl- 4- [(E)- (3- nitrophenyl)diazenyl]aniline
Smiles: CN(c1ccc(cc1)/N=N/c1cccc(c1)[N+](=O)[O-])C

STK676699
Synonyms: 4- [(E)- (3- methoxy- 5- nitrophenyl)diazenyl]- N,N- dimethylaniline
Smiles: COc1cc(/N=N/c2ccc(cc2)N(C)C)cc(c1)[N+](=O)[O-]

STK676700
Synonyms: 5- ({[3- (2- chlorophenyl)- 5- methyl- 1,2- oxazol- 4- yl]carbonyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(c1c(C)onc1c1ccccc1Cl)Nc1ccc(c(c1)C(=O)O)O

STK763166
Synonyms: 6- amino- 3- methyl- 4- (1- methyl- 1H- pyrrol- 2- yl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccn1C)c(C)n[nH]2

STK676701
Synonyms: 6- amino- 4- (1- methyl- 1H- pyrrol- 2- yl)- 3- phenyl- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccn1C)c(n[nH]2)c1ccccc1

STK763169
Synonyms: 2- (3,4- dihydroxyphenyl)- 5- hydroxy- 4- oxo- 4H- chromen- 7- ylhexopyranoside
Smiles: OCC1OC(Oc2cc(O)c3c(c2)oc(cc3=O)c2ccc(c(c2)O)O)C(C(C1O)O)O

STK763171
Synonyms: 2- (5- bromo- 2- hydroxyphenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: Oc1ccc(cc1C1NC(CS1)C(=O)O)Br

STK763178
Synonyms: S- (10,13- dimethyl- 3,5'- dioxo- 1,2,3,4',5',6,7,8,9,10,11,12,13,14,15,16- hexadecahydro- 3'H- spiro[cyclopenta[a]phenanthrene- 17,2'- furan]- 7- yl)ethanethioate
Smiles: CC(=O)SC1CC2=CC(=O)CCC2(C2C1C1CCC3(C1(CC2)C)CCC(=O)O3)C

STK763179
Synonyms: 4- acetyl- 1- cyclohexyl- 3- hydroxy- 5- phenyl- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccccc1)C1CCCCC1

STK763185
Synonyms: 4- acetyl- 1- (furan- 2- ylmethyl)- 3- hydroxy- 5- (4- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1ccco1

STK763186
Synonyms: 4- acetyl- 1- (furan- 2- ylmethyl)- 3- hydroxy- 5- [4- (propan- 2- yl)phenyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)C(C)C)Cc1ccco1

STK763199
Synonyms: 2- amino- 1- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 4,4- bis(trifluoromethyl)- 4,5,6,7- tetrahydro- 1H- cyclopenta[b]pyridine- 3- carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)N1C2=C(CCC2)C(C(=C1N)C#N)(C(F)(F)F)C(F)(F)F

STK676711
Synonyms: N- (2- {[2,2- bis(trifluoromethyl)- 1,3- dioxolan- 4- yl]methoxy}- 1,1,1,3,3,3- hexafluoropropan- 2- yl)furan- 2- carboxamide
Smiles: O=C(c1ccco1)NC(C(F)(F)F)(C(F)(F)F)OCC1COC(O1)(C(F)(F)F)C(F)(F)F

STK763203
Synonyms: (2- amino- 4- oxo- 5,6- dihydro- 4H- 1,3- thiazin- 5- yl)aceticacid
Smiles: NC1=NC(=O)C(CS1)CC(=O)O

STK763205
Synonyms: methyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- ethyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: COC(=O)c1nnn(c1CC)c1nonc1N

STK676713
Synonyms: 1- {2- [(4- methylphenyl)sulfonyl]ethyl}- 4- phenylpiperidin- 4- ol
Smiles: Cc1ccc(cc1)S(=O)(=O)CCN1CCC(CC1)(O)c1ccccc1

STK676714
Synonyms: 5- (1- {[2- (diethylamino)ethyl]amino}propylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCN(CCNC(=C1C(=O)NC(=O)NC1=O)CC)CC

STK763211
Synonyms: (5E)- 5- ({[2- (cyclohex- 1- en- 1- yl)ethyl]amino}methylidene)- 1- (2- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/NCCC1=CCCCC1)c1ccccc1F

STK763213
Synonyms: (5E)- 5- {[(2- methoxyphenyl)amino]methylidene}- 1- (4- methylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccccc1N/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)C

STK763228
Synonyms: 6- amino- 3- (methoxymethyl)- 4- (thiophen- 2- yl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: COCc1n[nH]c2c1C(c1cccs1)C(=C(O2)N)C#N

STK763231
Synonyms: 3- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- amine
Smiles: Cc1ccc(cc1)c1csc(n1)c1c(N)sc2c1CCCC2

STK763232
Synonyms: 5- ethyl- 2- (ethylsulfanyl)- 6- methylpyrimidin- 4(3H)- one
Smiles: CCSc1nc(C)c(c(=O)[nH]1)CC

STK763241
Synonyms: 3- (6- amino- 5- cyano- 3- propyl- 1,4- dihydropyrano[2,3- c]pyrazol- 4- yl)phenylfuran- 2- carboxylate
Smiles: CCCc1n[nH]c2c1C(c1cccc(c1)OC(=O)c1ccco1)C(=C(O2)N)C#N

STK763254
Synonyms: 6- amino- 4- (2- chloro- 6- fluorophenyl)- 3- (3- nitrophenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c(F)cccc1Cl)c(n[nH]2)c1cccc(c1)[N+](=O)[O-]

STK676721
Synonyms: 2,2- bis(trifluoromethyl)- 2,3,6,7- tetrahydro- 4H- [1,3]thiazolo[3,2- a][1,3,5]triazin- 4- one
Smiles: O=C1NC(N=C2N1CCS2)(C(F)(F)F)C(F)(F)F

STK763263
Synonyms: methyl2- (acetylamino)- N- (3- carbamoyl- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 3,3,3- trifluoroalaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1sc2c(c1C(=O)N)CCCC2)NC(=O)C

STK676724
Synonyms: N- (cyclohexylmethyl)hexan- 2- amine
Smiles: CCCCC(NCC1CCCCC1)C

STK676725
Synonyms: 7- bromo- 9- (2- hydroxy- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl)- 3,3- dimethyl- 2,3,4,9- tetrahydro- 1H- xanthen- 1- one
Smiles: Brc1ccc2c(c1)C(C1=C(O)CC(CC1=O)(C)C)C1=C(O2)CC(CC1=O)(C)C

STK676734
Synonyms: 2- {4- [(2- cyanobenzyl)oxy]- 3- methoxyphenyl}- 1,3- thiazolidine- 4- carboxylicacid
Smiles: COc1cc(ccc1OCc1ccccc1C#N)C1SCC(N1)C(=O)O

STK763288
Synonyms: 3,3'- (1- oxopropane- 1,3- diyl)bis(1,3- benzothiazol- 2(3H)- one)
Smiles: O=c1sc2c(n1CCC(=O)n1c(=O)sc3c1cccc3)cccc2

STK763289
Synonyms: 4- hydroxy- 4,5,5- trimethyl- 3- [3- (morpholin- 4- yl)propyl]- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1CCCN1CCOCC1)(C)O)(C)C

STK763290
Synonyms: ethyl4- oxo- 6- (trifluoromethoxy)- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1c[nH]c2c(c1=O)cc(cc2)OC(F)(F)F

STK763291
Synonyms: 2- (imidazo[1,2- a]pyridin- 2- yl)propan- 2- ol
Smiles: CC(c1nc2n(c1)cccc2)(O)C

STK763292
Synonyms: 2- (2- hydroxybenzyl)- 1- azabicyclo[2.2.2]octan- 3- one
Smiles: O=C1C2CCN(C1Cc1ccccc1O)CC2

STK676741
Synonyms: 8- azabicyclo[3.2.1]oct- 3- yl3,4- dimethoxybenzoate
Smiles: COc1cc(ccc1OC)C(=O)OC1CC2CCC(C1)N2

STK763293
Synonyms: 4- ({[1- (4- chlorophenyl)- 1H- tetrazol- 5- yl]sulfanyl}methyl)- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- amine
Smiles: Nc1nc(CSc2nnnn2c2ccc(cc2)Cl)nc(n1)N1CCOCC1

STK676742
Synonyms: 2- (6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinolin- 1- yl)phenol
Smiles: COc1cc2c(cc1OC)CCNC2c1ccccc1O

STK763298
Synonyms: [1,2,5]oxadiazolo[3,4- d]pyridazine- 4,7- diamine1- oxide
Smiles: Nc1nnc(c2c1no[n+]2[O-])N

STK676745
Synonyms: 1,3,5- triazine- 2,4,6- triamine1,3,5- trioxide
Smiles: Nc1[n+]([O-])c(N)[n+](c([n+]1[O-])N)[O-]

STK763299
Synonyms: ethylN- [(4- nitro- 1H- pyrazol- 5- yl)carbonyl]glycinate
Smiles: [O-][N+](=O)c1cn[nH]c1C(=O)NCC(=O)OCC

STK676748
Synonyms: 2- phenyl- 2H- [1,2,3]triazolo[4,5- d]pyrimidin- 7- ol
Smiles: Oc1ncnc2c1nn(n2)c1ccccc1

STK676749
Synonyms: 4- amino- N- (2- hydroxyethyl)- 1,2,5- oxadiazole- 3- carboxamide
Smiles: Nc1nonc1C(=O)NCCO

STK763302
Synonyms: 4- amino- N- benzyl- 1,2,5- oxadiazole- 3- carboxamide
Smiles: O=C(c1nonc1N)NCc1ccccc1

STK763307
Synonyms: 2- benzyl- 4,6- dinitro- 1,2- benzothiazol- 3(2H)- one1- oxide
Smiles: [O-][N+](=O)c1cc(cc2c1c(=O)n(s2=O)Cc1ccccc1)[N+](=O)[O-]

STK763310
Synonyms: methyl[(2- cyano- 5- nitrophenyl)sulfanyl]acetate
Smiles: [O-][N+](=O)c1cc(SCC(=O)OC)c(cc1)C#N

STK763312
Synonyms: 4- azido- N- benzyl- N- methyl- 2,6- dinitrobenzamide
Smiles: [N-]=[N+]=Nc1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C(=O)N(Cc1ccccc1)C

STK676753
Synonyms: methyl3- amino- 4- azido- 6- nitro- 1- benzothiophene- 2- carboxylate
Smiles: [N-]=[N+]=Nc1cc(cc2c1c(N)c(s2)C(=O)OC)[N+](=O)[O-]

STK676755
Synonyms: 3- (1- ethylpiperidin- 3- yl)- 4- hydroxy- 4,5,5- trimethyl- 1,3- oxazolidin- 2- one
Smiles: CCN1CCCC(C1)N1C(=O)OC(C1(C)O)(C)C

STK763331
Synonyms: 2- [(8- bromo- 5- methyl- 5H- [1,2,4]triazino[5,6- b]indol- 3- yl)sulfanyl]- N- [4- (trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CSc1nnc2c(n1)n(C)c1c2cc(cc1)Br

STK676765
Synonyms: 2- [4- (naphthalen- 1- ylmethoxy)phenyl]- 1,3- thiazolidine- 4- carboxylicacid
Smiles: OC(=O)C1CSC(N1)c1ccc(cc1)OCc1cccc2c1cccc2

STK676767
Synonyms: 4- ({[1- (4- fluorophenyl)- 2,5- dioxopyrrolidin- 3- yl]amino}methyl)benzoicacid
Smiles: Fc1ccc(cc1)N1C(=O)CC(C1=O)NCc1ccc(cc1)C(=O)O

STK676768
Synonyms: 2- (1,3- benzodioxol- 5- yl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- ol
Smiles: Oc1nc(nc2c1c1CCCCc1s2)c1ccc2c(c1)OCO2

STK763348
Synonyms: 1,1'- {6- hydroxy- 2- (4- methoxyphenyl)- 4- [(4- methoxyphenyl)amino]- 6- methylcyclohex- 3- ene- 1,3- diyl}diethanone
Smiles: COc1ccc(cc1)NC1=C(C(=O)C)C(C(C(C1)(C)O)C(=O)C)c1ccc(cc1)OC

STK763358
Synonyms: 1,1'- {6- hydroxy- 2- (3- methoxyphenyl)- 4- [(4- methoxyphenyl)amino]- 6- methylcyclohex- 3- ene- 1,3- diyl}diethanone
Smiles: COc1ccc(cc1)NC1=C(C(=O)C)C(C(C(C1)(C)O)C(=O)C)c1cccc(c1)OC

STK676783
Synonyms: 2- cyano- 3- (furan- 2- yl)- 3- (6- hydroxy- 2,2- dimethyl- 4- oxo- 4H- 1,3- dioxin- 5- yl)propanamide
Smiles: N#CC(C(C1=C(O)OC(OC1=O)(C)C)c1ccco1)C(=O)N

STK763362
Synonyms: 2- benzyl- 5- oxocyclohexanecarboxylicacid
Smiles: O=C1CCC(C(C1)C(=O)O)Cc1ccccc1

STK676785
Synonyms: 2,5- dimethyl- 1- (3- methylbutyl)- 4- phenylpiperidin- 4- ol
Smiles: CC(CCN1CC(C)C(CC1C)(O)c1ccccc1)C

STK763376
Synonyms: 6- amino- 4- (biphenyl- 4- yl)- 3- methyl- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)c1ccccc1)c(C)n[nH]2

STK763382
Synonyms: methyl6- tert- butyl- 2- {[(1,3- dimethyl- 1H- pyrazol- 4- yl)carbonyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1cn(nc1C)C

STK763393
Synonyms: 1- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)thiourea
Smiles: N#Cc1c(NC(=S)N)sc2c1CCCC2

STK763394
Synonyms: N- (cyclohexylmethyl)- 10H- phenothiazine- 10- carboxamide
Smiles: O=C(N1c2ccccc2Sc2c1cccc2)NCC1CCCCC1

STK676787
Synonyms: 3- [(2- methylcyclohexyl)amino]- 1- phenylpyrrolidine- 2,5- dione
Smiles: CC1CCCCC1NC1CC(=O)N(C1=O)c1ccccc1

STK676789
Synonyms: N- (2,6- dimethylphenyl)- N~2~- (3,4,5,6- tetrahydro- 2H- azepin- 7- yl)alaninamide
Smiles: CC(C(=O)Nc1c(C)cccc1C)NC1=NCCCCC1

STK676790
Synonyms: 6- {4- [4- chloro- 6- (diphenylamino)- 1,3,5- triazin- 2- yl]piperazin- 1- yl}- N,N'- bis(4- methoxyphenyl)- 1,3,5- triazine- 2,4- diamine
Smiles: COc1ccc(cc1)Nc1nc(Nc2ccc(cc2)OC)nc(n1)N1CCN(CC1)c1nc(Cl)nc(n1)N(c1ccccc1)c1ccccc1

STK763398
Synonyms: 4- [(7- chloroquinolin- 4- yl)amino]benzoicacid
Smiles: Clc1ccc2c(c1)nccc2Nc1ccc(cc1)C(=O)O

STK676793
Synonyms: N- cyclohexyl- 4,6- bis[(1,1,1,3,3,3- hexafluoropropan- 2- yl)oxy]- 1,3,5- triazin- 2- amine
Smiles: FC(C(C(F)(F)F)Oc1nc(NC2CCCCC2)nc(n1)OC(C(F)(F)F)C(F)(F)F)(F)F

STK763419
Synonyms: 6- amino- 3- (methoxymethyl)- 4- (2,4,5- trimethoxyphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: COCc1n[nH]c2c1C(C(=C(O2)N)C#N)c1cc(OC)c(cc1OC)OC

STK763429
Synonyms: 6- amino- 3- methyl- 4- (2,4,6- trimethoxyphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c(OC)cc(cc1OC)OC)c(C)n[nH]2

STK763449
Synonyms: 5- amino- 1- phenyl- 3,3- bis(trifluoromethyl)- 2,3- dihydro- 1H- pyrazole- 4- carbonitrile
Smiles: N#CC1=C(N)N(NC1(C(F)(F)F)C(F)(F)F)c1ccccc1

STK676798
Synonyms: methyl(2Z)- 3- (1H- indol- 3- yl)- 2- [(trifluoroacetyl)amino]prop- 2- enoate
Smiles: COC(=O)/C(=C/c1c[nH]c2c1cccc2)/NC(=O)C(F)(F)F

STK763461
Synonyms: 2- methoxy- 4- [(Z)- (3- oxo[1,3]thiazolo[3,2- a]benzimidazol- 2(3H)- ylidene)methyl]phenylpropanoate
Smiles: CCC(=O)Oc1ccc(cc1OC)/C=c/1\sc2n(c1=O)c1c(n2)cccc1

STK763462
Synonyms: 2- [2- (4- amino- 1,2,5- oxadiazol- 3- yl)- 1H- benzimidazol- 1- yl]- N- (2,4- difluorophenyl)acetamide
Smiles: O=C(Cn1c(nc2c1cccc2)c1nonc1N)Nc1ccc(cc1F)F

STK676800
Synonyms: 3- (2- bromoethyl)- 7- methoxy- 1,5- dinitro- 3- azabicyclo[3.3.1]non- 6- ene
Smiles: BrCCN1CC2(CC(=CC(C1)(C2)[N+](=O)[O-])OC)[N+](=O)[O-]

STK676801
Synonyms: 3- benzyl- 6- (2- chloroethoxy)- 1,5- dinitro- 3- azabicyclo[3.3.1]non- 6- ene
Smiles: ClCCOC1=CCC2(CC1(CN(C2)Cc1ccccc1)[N+](=O)[O-])[N+](=O)[O-]

STK763470
Synonyms: 2- hydroxy- 1- [(E)- (2- hydroxy- 1H- indol- 3- yl)diazenyl]- 2- propylpentan- 1- one
Smiles: CCCC(C(=O)/N=N/c1c(O)[nH]c2c1cccc2)(CCC)O

STK676806
Synonyms: N- (3- chlorophenyl)- N'- [hydroxy(diphenyl)acetyl]furan- 2- carbohydrazide
Smiles: Clc1cccc(c1)N(C(=O)c1ccco1)NC(=O)C(c1ccccc1)(c1ccccc1)O

STK763476
Synonyms: 2- hydroxy- 2,2- bis(2- methylphenyl)- N',N'- diphenylacetohydrazide
Smiles: Cc1ccccc1C(c1ccccc1C)(C(=O)NN(c1ccccc1)c1ccccc1)O

STK763478
Synonyms: 4- [(3- methoxyphenoxy)methyl]- 2,2- dimethyl- 1,2- dihydrobenzo[f]isoquinoline
Smiles: COc1cccc(c1)OCC1=NC(C)(C)Cc2c1ccc1c2cccc1

STK763483
Synonyms: ethyl4- (2- bromophenyl)- 1- (2- hydroxyethyl)- 6- methyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: OCCN1C(=O)NC(C(=C1C)C(=O)OCC)c1ccccc1Br

STK676808
Synonyms: ethyl1- (2- hydroxyethyl)- 4- (2- hydroxyphenyl)- 6- methyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: OCCN1C(=O)NC(C(=C1C)C(=O)OCC)c1ccccc1O

STK763493
Synonyms: 1- [1- (3- fluorophenyl)- 6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl]ethanone
Smiles: COc1cc2c(cc1OC)CCN(C2c1cccc(c1)F)C(=O)C

STK763499
Synonyms: N- (4- methoxyphenyl)- 2- methyl- 4,5,6,7- tetrahydro- 1- benzofuran- 3- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(C)oc2c1CCCC2

STK763503
Synonyms: 2- [(4,6- dihydroxypyrimidin- 2- yl)sulfanyl]- N,N- diethylacetamide
Smiles: CCN(C(=O)CSc1nc(O)cc(n1)O)CC

STK763505
Synonyms: 6,6,8a- trimethyl- 3a,6,7,8a- tetrahydrofuro[2,3- b][1]benzofuran- 2,4(3H,5H)- dione
Smiles: O=C1CC2C(O1)(C)OC1=C2C(=O)CC(C1)(C)C

STK676813
Synonyms: 3- [4- (diphenylmethyl)piperazin- 1- yl]- 5- methyl- 5H- pyridazino[3,4- b][1,4]benzoxazine
Smiles: CN1c2cc(nnc2Oc2c1cccc2)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK676814
Synonyms: 3- (4- benzylpiperazin- 1- yl)- 5- methyl- 5H- pyridazino[3,4- b][1,4]benzoxazine
Smiles: CN1c2cc(nnc2Oc2c1cccc2)N1CCN(CC1)Cc1ccccc1

STK676815
Synonyms: N- [(2Z)- 2- (acetylamino)- 3- (1H- indol- 3- yl)prop- 2- enoyl]tryptophan
Smiles: CC(=O)N/C(=C\c1c[nH]c2c1cccc2)/C(=O)NC(C(=O)O)Cc1c[nH]c2c1cccc2

STK763510
Synonyms: N- [(4- phenyl- 1,3- thiazol- 2- yl)methyl]benzamide
Smiles: O=C(c1ccccc1)NCc1scc(n1)c1ccccc1

STK763512
Synonyms: 6- amino- 4- (3,4- dimethoxyphenyl)- 3- (methoxymethyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: COCc1n[nH]c2c1C(c1ccc(c(c1)OC)OC)C(=C(O2)N)C#N

STK763513
Synonyms: 4- (6- amino- 5- cyano- 3- methyl- 1,4- dihydropyrano[2,3- c]pyrazol- 4- yl)- 2- ethoxyphenylmorpholine- 4- carboxylate
Smiles: CCOc1cc(ccc1OC(=O)N1CCOCC1)C1C(=C(N)Oc2c1c(C)n[nH]2)C#N

STK763520
Synonyms: ethylN- (3- cyano- 4- ethyl- 5- methylthiophen- 2- yl)- 3,3,3- trifluoro- 2- [(3- methylbutanoyl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc(c(c1C#N)CC)C)NC(=O)CC(C)C

STK763530
Synonyms: 2- amino- 1- (3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)- 6- methyl- 4,4- bis(trifluoromethyl)- 1,4- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1c(sc2c1CCCCC2)N1C(=CC(C(=C1N)C#N)(C(F)(F)F)C(F)(F)F)C

STK676823
Synonyms: N- (2- {[2,2- bis(trifluoromethyl)- 1,3- dioxolan- 4- yl]methoxy}- 1,1,1,3,3,3- hexafluoropropan- 2- yl)propanamide
Smiles: CCC(=O)NC(C(F)(F)F)(C(F)(F)F)OCC1COC(O1)(C(F)(F)F)C(F)(F)F

STK763535
Synonyms: 2- methyl- N- (naphthalen- 1- yl)- 4,5,6,7- tetrahydro- 1- benzofuran- 3- carboxamide
Smiles: O=C(c1c(C)oc2c1CCCC2)Nc1cccc2c1cccc2

STK763548
Synonyms: 4- [(E)- 2- (6- bromo- 1,3- benzodioxol- 5- yl)ethenyl]- 6- (trifluoromethyl)pyrimidin- 2(1H)- one
Smiles: O=c1nc(/C=C/c2cc3OCOc3cc2Br)cc([nH]1)C(F)(F)F

STK763553
Synonyms: 2- ({6- [ethyl(phenyl)amino][1,2,5]oxadiazolo[3,4- b]pyrazin- 5- yl}amino)ethanol
Smiles: CCN(c1nc2nonc2nc1NCCO)c1ccccc1

STK763554
Synonyms: 5,6- di(pyrrolidin- 1- yl)[1,2,5]oxadiazolo[3,4- b]pyrazine
Smiles: C1CCN(C1)c1nc2nonc2nc1N1CCCC1

STK763557
Synonyms: 4,4'- ([1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diyldiimino)diphenol
Smiles: Oc1ccc(cc1)Nc1nc2nonc2nc1Nc1ccc(cc1)O

STK763586
Synonyms: methyl3- [5- (4- aminophenoxy)- 1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl]benzoate
Smiles: COC(=O)c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)Oc1ccc(cc1)N

STK763598
Synonyms: N- {4- [2- amino- 3- cyano- 6- methyl- 4,4- bis(trifluoromethyl)pyridin- 1(4H)- yl]phenyl}acetamide
Smiles: N#CC1=C(N)N(C(=CC1(C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)NC(=O)C

STK763601
Synonyms: 3,5,5- trimethyl- 6- phenyldihydro- 2H- pyran- 2,4(3H)- dione
Smiles: O=C1OC(c2ccccc2)C(C(=O)C1C)(C)C

STK763603
Synonyms: 2- amino- 5- methyl- 8- (propan- 2- yl)- 6,7- dihydro- 5H- chromene- 3,4- dicarbonitrile
Smiles: N#CC1=C2C(C)CCC(=C2OC(=C1C#N)N)C(C)C

STK676837
Synonyms: 1- {[3- (acetyloxy)propyl]amino}- 9,10- dioxo- 9,10- dihydroanthracene- 2- carboxylicacid
Smiles: CC(=O)OCCCNc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)O

STK676838
Synonyms: 1- [(3- hydroxypropyl)amino]- 9,10- dioxo- 9,10- dihydroanthracene- 2- carboxylicacid
Smiles: OCCCNc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)O

STK763607
Synonyms: 3- [(4- bromophenyl)amino]- 5- phenyl- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Brc1ccc(cc1)NC1=C(C(NC1=O)c1ccccc1)C(=O)c1ccccc1

STK763622
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- N- methyl- 2- (naphthalen- 2- yloxy)acetamide
Smiles: O=C(N(c1c(=O)n(n(c1C)C)c1ccccc1)C)COc1ccc2c(c1)cccc2

STK763637
Synonyms: (5E)- 5- (furan- 2- ylmethylidene)- 1- (4- methoxybenzyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)CN1C(=O)NC(=O)/C(=C\c2ccco2)/C1=O

STK763668
Synonyms: (5E)- 1- (3- methoxyphenyl)- 5- (thiophen- 2- ylmethylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cccc(c1)N1C(=O)NC(=O)/C(=C\c2cccs2)/C1=O

STK763680
Synonyms: 2- [(1,1- dioxido- 1,2- benzothiazol- 3- yl)(2- methoxyphenyl)amino]ethyl5- oxo- 1- phenylpyrrolidine- 3- carboxylate
Smiles: COc1ccccc1N(C1=NS(=O)(=O)c2c1cccc2)CCOC(=O)C1CC(=O)N(C1)c1ccccc1

STK676850
Synonyms: 2- {[4- methyl- 5- (naphthalen- 1- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (tetrahydrofuran- 2- ylmethyl)acetamide
Smiles: O=C(CSc1nnc(n1C)Cc1cccc2c1cccc2)NCC1CCCO1

STK763682
Synonyms: [(E)- 2- phenylethenyl]phosphonicacid
Smiles: OP(=O)(/C=C/c1ccccc1)O

STK763683
Synonyms: 4- nitro- 2- (prop- 2- yn- 1- yl)- 2H- 1,2,3- triazole
Smiles: C#CCn1ncc(n1)[N+](=O)[O-]

STK676857
Synonyms: 3- (ethylsulfanyl)- 2- phenylquinoline- 4- carboxylicacid
Smiles: CCSc1c(nc2c(c1C(=O)O)cccc2)c1ccccc1

STK763693
Synonyms: 2- {1- [(4- chlorophenyl)carbonyl]- 5- methoxy- 2- methyl- 1H- indol- 3- yl}- N- [4- (propan- 2- yl)benzyl]acetamide
Smiles: COc1ccc2c(c1)c(CC(=O)NCc1ccc(cc1)C(C)C)c(n2C(=O)c1ccc(cc1)Cl)C

STK763695
Synonyms: ethyl6- [chloro(difluoro)methoxy]- 4- oxo- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1c[nH]c2c(c1=O)cc(cc2)OC(Cl)(F)F

STK676860
Synonyms: 4- hydroxy- 4,5- dimethyl- 3- (2,2,6,6- tetramethylpiperidin- 4- yl)- 5- [2- (2,6,6- trimethylcyclohex- 1- en- 1- yl)ethyl]- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1C1CC(C)(C)NC(C1)(C)C)(C)O)(C)CCC1=C(C)CCCC1(C)C

STK676862
Synonyms: 1- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- N- methylethanamine
Smiles: CNC(c1ccc2c(c1)OCCO2)C

STK763699
Synonyms: 8- (4- hydroxyphenyl)- 11,11- dimethyl- 8,10,11,12- tetrahydrobenzo[a][4,7]phenanthrolin- 9(7H)- one
Smiles: Oc1ccc(cc1)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccn3

STK763704
Synonyms: methyl[1- (2- amino- 4- nitrophenyl)- 2- hydroxy- 3- oxo- 5- phenyl- 2,3- dihydro- 1H- pyrrol- 2- yl]acetate
Smiles: COC(=O)CC1(O)C(=O)C=C(N1c1ccc(cc1N)[N+](=O)[O-])c1ccccc1

STK763705
Synonyms: (5R,6S)- 6- (2,4- dichlorophenyl)- 3,3- dimethyl- 5- (propan- 2- yl)dihydro- 2H- pyran- 2,4(3H)- dione
Smiles: Clc1ccc(c(c1)Cl)[C@H]1OC(=O)C(C(=O)[C@@H]1C(C)C)(C)C

STK676867
Synonyms: [4- (3,4- dichlorophenyl)piperazin- 1- yl][5- (3- hydroxy- 3- methylbut- 1- yn- 1- yl)furan- 2- yl]methanone
Smiles: O=C(c1ccc(o1)C#CC(O)(C)C)N1CCN(CC1)c1ccc(c(c1)Cl)Cl

STK763710
Synonyms: (5Z)- 3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 2- imino- 5- [(2- methyl- 1H- indol- 3- yl)methylidene]- 1,3- thiazolidin- 4- one
Smiles: N=C1S/C(=C\c2c(C)[nH]c3c2cccc3)/C(=O)N1c1nonc1N

STK763711
Synonyms: 2- (4- {(Z)- [3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 2- imino- 4- oxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- ethoxyphenoxy)acetamide
Smiles: CCOc1cc(ccc1OCC(=O)N)/C=C/1\SC(=N)N(C1=O)c1nonc1N

STK763712
Synonyms: (5Z)- 3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (3- ethoxy- 4- hydroxybenzylidene)- 2- imino- 1,3- thiazolidin- 4- one
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=N)N(C1=O)c1nonc1N

STK763713
Synonyms: (5Z)- 3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (furan- 2- ylmethylidene)- 2- imino- 1,3- thiazolidin- 4- one
Smiles: N=C1S/C(=C\c2ccco2)/C(=O)N1c1nonc1N

STK676870
Synonyms: N- (5- bromopyridin- 2- yl)- 4- (ethylsulfanyl)- 3- nitrobenzamide
Smiles: CCSc1ccc(cc1[N+](=O)[O-])C(=O)Nc1ccc(cn1)Br

STK763715
Synonyms: 4- methylspiro[1,3- dioxane- 2,3'- indol]- 2'(1'H)- one
Smiles: CC1CCOC2(O1)C(=O)Nc1c2cccc1

STK763719
Synonyms: 4- acetyl- 1- (1,3- benzothiazol- 2- yl)- 3- hydroxy- 5- (4- methylphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C1N(c2nc3c(s2)cccc3)C(=O)C(=C1C(=O)C)O

STK763720
Synonyms: 1- [(E)- (5- bromo- 2- hydroxy- 1H- indol- 3- yl)diazenyl]- 2- hydroxy- 2- methylpropan- 1- one
Smiles: O=C(C(O)(C)C)/N=N/c1c(O)[nH]c2c1cc(Br)cc2

STK763721
Synonyms: 2- ethyl- 2- hydroxy- 1- [(E)- (2- hydroxy- 1- methyl- 1H- indol- 3- yl)diazenyl]butan- 1- one
Smiles: CCC(C(=O)/N=N/c1c(O)n(c2c1cccc2)C)(CC)O

STK763722
Synonyms: 2- hydroxy- 1- [(E)- (2- hydroxy- 1- methyl- 1H- indol- 3- yl)diazenyl]- 2,2- diphenylethanone
Smiles: Oc1n(C)c2c(c1/N=N/C(=O)C(c1ccccc1)(c1ccccc1)O)cccc2

STK763723
Synonyms: 1- [(E)- (5- bromo- 2- hydroxy- 1H- indol- 3- yl)diazenyl]- 2- hydroxy- 2- propylpentan- 1- one
Smiles: CCCC(C(=O)/N=N/c1c(O)[nH]c2c1cc(Br)cc2)(CCC)O

STK763733
Synonyms: 2- cyano- N- [4- (2,5- dimethyl- 1H- pyrrol- 1- yl)butyl]acetamide
Smiles: N#CCC(=O)NCCCCn1c(C)ccc1C

STK676886
Synonyms: [3- (2- chlorophenyl)- 5- methyl- 1,2- oxazol- 4- yl][2- (4- methoxyphenyl)- 1,3- thiazolidin- 3- yl]methanone
Smiles: COc1ccc(cc1)C1SCCN1C(=O)c1c(C)onc1c1ccccc1Cl

STK763740
Synonyms: (5Z)- 2- imino- 5- [(2- methyl- 1H- indol- 3- yl)methylidene]- 3- (1,3- thiazol- 2- yl)- 1,3- thiazolidin- 4- one
Smiles: N=C1S/C(=C\c2c(C)[nH]c3c2cccc3)/C(=O)N1c1nccs1

STK763741
Synonyms: 2- (2- ethoxy- 4- {(Z)- [2- imino- 4- oxo- 3- (1,3- thiazol- 2- yl)- 1,3- thiazolidin- 5- ylidene]methyl}phenoxy)acetamide
Smiles: CCOc1cc(ccc1OCC(=O)N)/C=C/1\SC(=N)N(C1=O)c1nccs1

STK763744
Synonyms: (5Z)- 5- [4- (dimethylamino)benzylidene]- 2- imino- 3- (1,3- thiazol- 2- yl)- 1,3- thiazolidin- 4- one
Smiles: N=C1S/C(=C\c2ccc(cc2)N(C)C)/C(=O)N1c1nccs1

STK763745
Synonyms: (5Z)- 2- imino- 5- {[1- phenyl- 3- (thiophen- 2- yl)- 1H- pyrazol- 4- yl]methylidene}- 3- (1,3- thiazol- 2- yl)- 1,3- thiazolidin- 4- one
Smiles: N=C1S/C(=C\c2cn(nc2c2cccs2)c2ccccc2)/C(=O)N1c1nccs1

STK763746
Synonyms: (5Z)- 5- {3- ethoxy- 4- [2- (morpholin- 4- yl)ethoxy]benzylidene}- 2- imino- 3- (1,3- thiazol- 2- yl)- 1,3- thiazolidin- 4- one
Smiles: CCOc1cc(ccc1OCCN1CCOCC1)/C=C/1\SC(=N)N(C1=O)c1nccs1

STK763749
Synonyms: (5Z)- 3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[3- (4- fluorophenyl)- 1H- pyrazol- 4- yl]methylidene}- 2- imino- 1,3- thiazolidin- 4- one
Smiles: Fc1ccc(cc1)c1n[nH]cc1/C=C/1\SC(=N)N(C1=O)c1nonc1N

STK763750
Synonyms: (5Z)- 3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[3- (4- chlorophenyl)- 1H- pyrazol- 4- yl]methylidene}- 2- imino- 1,3- thiazolidin- 4- one
Smiles: Clc1ccc(cc1)c1n[nH]cc1/C=C/1\SC(=N)N(C1=O)c1nonc1N

STK676887
Synonyms: 2- [2- (1H- 1,2,4- triazol- 3- yl)ethyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1N(CCc2n[nH]cn2)C(=O)c2c1cccc2

STK676888
Synonyms: 2- oxa- 8- azaspiro[5.5]undecane- 1,3,9- trione
Smiles: O=C1CCC2(CN1)CCC(=O)OC2=O

STK763757
Synonyms: 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK763758
Synonyms: 5- cyano- 4- (furan- 2- yl)- 2- methyl- 6- {[2- oxo- 2- (1,3- thiazol- 2- ylamino)ethyl]sulfanyl}- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK763759
Synonyms: 5- cyano- 6- ({2- [(3,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK763760
Synonyms: 6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (furan- 2- yl)- 2- methyl- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK763761
Synonyms: 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 6- {[2- oxo- 2- (1,3- thiazol- 2- ylamino)ethyl]sulfanyl}- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK763762
Synonyms: 5- cyano- 6- ({2- [(2,4- dimethylphenyl)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(cc2C)C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK676891
Synonyms: 5- cyano- 6- ({2- [(3,4- dichlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)Cl)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK763763
Synonyms: 5- cyano- 6- ({2- [(4- ethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1cccs1

STK763764
Synonyms: 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK763765
Synonyms: 6- ({2- [(3- chloro- 2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK763766
Synonyms: 5- cyano- 6- ({2- [(2- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2CC)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK763767
Synonyms: 5- cyano- 6- ({2- [(3,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK763768
Synonyms: 5- cyano- 6- ({2- [(3,4- dimethylphenyl)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(c(c2)C)C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK763769
Synonyms: 5- cyano- 6- ({2- [(3,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- N- (2- methoxyphenyl)- 2- methyl- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK763770
Synonyms: 6- ({2- [(3- chloro- 2- 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)Nc2cccc(c2C)Cl)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK763771
Synonyms: 5- cyano- 6- ({2- [(2,5- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK763772
Synonyms: 5- cyano- 2- methyl- 6- ({2- [(2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK676892
Synonyms: 5- cyano- 6- ({2- [(3,4- dichlorophenyl)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(c(c2)Cl)Cl)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK763773
Synonyms: 5- cyano- 6- ({2- [(2,3- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK763774
Synonyms: 5- cyano- 6- ({2- [(4- ethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- (2- methylphenyl)- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1C)c1cccs1

STK676893
Synonyms: 5- cyano- 6- ({2- [(3,4- dichlorophenyl)amino]- 2- oxoethyl}sulfanyl)- N- (2- methoxyphenyl)- 2- methyl- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)Cl)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK676894
Synonyms: 6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK763775
Synonyms: 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- N- (2- methoxyphenyl)- 2- methyl- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK763776
Synonyms: 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 6- {[2- oxo- 2- (phenylamino)ethyl]sulfanyl}- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK763777
Synonyms: 6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- N- phenyl- 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)Nc1ccccc1)C

STK763778
Synonyms: 2- [(3- cyano- 6- oxo- 4- phenyl- 1,4,5,6- tetrahydropyridin- 2- yl)sulfanyl]- N- (1,3- thiazol- 2- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)NC(=O)CC1c1ccccc1

STK763789
Synonyms: 6- cyclopropyl- 4- (furan- 2- yl)- 2- (methylsulfanyl)pyridine- 3- carbonitrile
Smiles: CSc1nc(cc(c1C#N)c1ccco1)C1CC1

STK763790
Synonyms: methyl{[(7E)- 3- cyano- 4- (thiophen- 2- yl)- 7- (thiophen- 2- ylmethylidene)- 6,7- dihydro- 5H- cyclopenta[b]pyridin- 2- yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc2/C(=C/c3cccs3)/CCc2c(c1C#N)c1cccs1

STK676896
Synonyms: (7E)- 2- {[2- (2,4- dichlorophenyl)- 2- oxoethyl]sulfanyl}- 4- (thiophen- 2- yl)- 7- (thiophen- 2- ylmethylidene)- 6,7- dihydro- 5H- cyclopenta[b]pyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2Cl)Cl)nc2c(c1c1cccs1)CC/C/2=C\c1cccs1

STK763793
Synonyms: 6- cyclopropyl- 4- (furan- 2- yl)- 2- [(2- oxo- 2- phenylethyl)sulfanyl]pyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccccc2)nc(cc1c1ccco1)C1CC1

STK763795
Synonyms: 2- imino- N- (4- methylphenyl)- 2H- chromene- 3- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1cc2ccccc2oc1=N

STK763802
Synonyms: N- (1,3- benzodioxol- 5- yl)- 6- (3,5- dimethylpiperidin- 1- yl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: CC1CC(C)CN(C1)c1nc2nonc2nc1Nc1ccc2c(c1)OCO2

STK763807
Synonyms: ethyl({4- [4- (benzyloxy)phenyl]- 3- cyano- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl}sulfanyl)acetate
Smiles: CCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)OCc1ccccc1

STK763818
Synonyms: 4- [(E)- 2- (4- chlorophenyl)ethenyl]- 6- (trifluoromethyl)pyrimidin- 2(1H)- one
Smiles: Clc1ccc(cc1)/C=C/c1nc(=O)[nH]c(c1)C(F)(F)F

STK763822
Synonyms: 2- phenyl- 6- (piperidin- 1- yl)- 3H- dibenzo[de,h]cinnoline- 3,7(2H)- dione
Smiles: O=c1c2ccccc2c2c3c1c(ccc3c(=O)n(n2)c1ccccc1)N1CCCCC1

STK763851
Synonyms: 1- [1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 4- methyl- 1H- 1,2,3- triazol- 5- yl]ethanone
Smiles: CC(=O)c1c(C)nnn1c1nonc1N

STK763852
Synonyms: 4- [(1- methyl- 4- nitro- 1H- imidazol- 5- yl)amino]phenol
Smiles: Oc1ccc(cc1)Nc1n(C)cnc1[N+](=O)[O-]

STK763853
Synonyms: 8- [(2,4- dichlorobenzyl)sulfanyl]- 7- ethyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(SCc2ccc(cc2Cl)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK676904
Synonyms: (4- {[(5- tert- butyl- 2- methylfuran- 3- yl)carbonyl]amino}phenyl)aceticacid
Smiles: OC(=O)Cc1ccc(cc1)NC(=O)c1cc(oc1C)C(C)(C)C

STK763855
Synonyms: ethyl(4- butyl- 3,5- dioxo- 1,2- diphenylpyrazolidin- 4- yl)acetate
Smiles: CCCCC1(CC(=O)OCC)C(=O)N(N(C1=O)c1ccccc1)c1ccccc1

STK763857
Synonyms: 2- {[3- cyano- 4- (3- ethoxy- 4- hydroxyphenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(c(c1)OCC)O

STK763860
Synonyms: 5- (4- methoxyphenyl)- 7- (3,4,5- trimethoxyphenyl)- 4,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: COc1ccc(cc1)C1=CC(n2c(N1)ncn2)c1cc(OC)c(c(c1)OC)OC

STK763864
Synonyms: methyl(3alpha)- 12- oxo- 3- [(phenylcarbonyl)oxy]cholan- 24- oate
Smiles: COC(=O)CCC(C1CCC2C1(C)C(=O)CC1C2CCC2C1(C)CC[C@H](C2)OC(=O)c1ccccc1)C

STK763866
Synonyms: 3- (prop- 2- en- 1- yloxy)estra- 1,3,5(10)- trien- 17- one
Smiles: C=CCOc1ccc2c(c1)CCC1C2CCC2(C1CCC2=O)C

STK676907
Synonyms: (8xi,9xi,14xi)- androstan- 17- amine
Smiles: NC1CCC2[C@]1(C)CCC1C2CCC2[C@]1(C)CCCC2

STK763878
Synonyms: 2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl4- bromo- 3- (morpholin- 4- ylsulfonyl)benzoate
Smiles: O=C(c1ccc(c(c1)S(=O)(=O)N1CCOCC1)Br)OCC1COc2c(O1)cccc2

STK676917
Synonyms: 4- fluoro- 3- (morpholin- 4- ylsulfonyl)- N- (5- phenyl- 1,3,4- oxadiazol- 2- yl)benzamide
Smiles: O=C(c1ccc(c(c1)S(=O)(=O)N1CCOCC1)F)Nc1nnc(o1)c1ccccc1

STK763887
Synonyms: [1- benzyl- 3- (phenylsulfanyl)- 1H- indol- 2- yl]aceticacid
Smiles: OC(=O)Cc1n(Cc2ccccc2)c2c(c1Sc1ccccc1)cccc2

STK763888
Synonyms: methyl3- {[(2- hydroxyphenyl)carbonyl]amino}- 1- benzofuran- 2- carboxylate
Smiles: COC(=O)c1oc2c(c1NC(=O)c1ccccc1O)cccc2

STK676926
Synonyms: 2- {4- [4,6- di(piperidin- 1- yl)- 1,3,5- triazin- 2- yl]piperazin- 1- yl}ethanol
Smiles: OCCN1CCN(CC1)c1nc(nc(n1)N1CCCCC1)N1CCCCC1

STK676927
Synonyms: 4- amino- N- (2- methoxyethyl)- 1,2,5- oxadiazole- 3- carboxamide
Smiles: COCCNC(=O)c1nonc1N

STK763902
Synonyms: methyl{2- [hydroxy(phenyl)methyl]- 1H- benzimidazol- 1- yl}acetate
Smiles: COC(=O)Cn1c(nc2c1cccc2)C(c1ccccc1)O

STK763904
Synonyms: 2- imino- 10- (4- methoxyphenyl)tetrahydro- 8a,3- (epoxymethano)chromene- 3,4,4(2H,4aH)- tricarbonitrile
Smiles: N#CC12C(=N)OC3(OC1c1ccc(cc1)OC)C(C2(C#N)C#N)CCCC3

STK676929
Synonyms: 8,8- dimethyl- 3,5- diphenyl- 1,4,5,7,8,9- hexahydro- 6H- 1,2- benzodiazepin- 6- one
Smiles: O=C1CC(C)(C)CC2=C1C(CC(=NN2)c1ccccc1)c1ccccc1

STK676930
Synonyms: 2- oxo- 2- phenylethyl{1- [(4- chlorophenyl)carbonyl]- 5- methoxy- 2- methyl- 1H- indol- 3- yl}acetate
Smiles: COc1ccc2c(c1)c(CC(=O)OCC(=O)c1ccccc1)c(n2C(=O)c1ccc(cc1)Cl)C

STK763910
Synonyms: 9- [(4- bromo- 3- chlorophenyl)amino]- 4- methyl- 2H- furo[2,3- h]chromen- 2- one
Smiles: O=c1cc(C)c2c(o1)c1c(coc1cc2)Nc1ccc(c(c1)Cl)Br

STK763911
Synonyms: 5- hydroxy- 3- (4- methoxyphenyl)- 7- oxo- 6- azabicyclo[3.2.1]octane- 1,2,2- tricarbonitrile
Smiles: N#CC1(C#N)C(CC2(CC1(C#N)C(=O)N2)O)c1ccc(cc1)OC

STK763914
Synonyms: 3- (3- chlorophenyl)- 1- (2- cyanoethyl)- 1- phenylurea
Smiles: N#CCCN(c1ccccc1)C(=O)Nc1cccc(c1)Cl

STK763918
Synonyms: 5- methyl- 2- (4- methylphenyl)- 5- (2- methylpropyl)- 1,2,4- triazolidine- 3- thione
Smiles: CC(CC1(C)NC(=S)N(N1)c1ccc(cc1)C)C

STK676934
Synonyms: 4- chloro- N- (2,2- difluoro- 1,3- benzodioxol- 5- yl)- 3- nitrobenzamide
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])Cl)Nc1ccc2c(c1)OC(O2)(F)F

STK763925
Synonyms: N'- [4- chloro- 5- (2,2- dicyanoethenyl)- 1,3- thiazol- 2- yl]- N,N- dimethylimidoformamide
Smiles: N#CC(=Cc1sc(nc1Cl)/N=C/N(C)C)C#N

STK676936
Synonyms: N- [(2,5- dimethylfuran- 3- yl)carbonyl]tryptophan
Smiles: OC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)c1cc(oc1C)C

STK763928
Synonyms: 1- [(2- chlorophenyl)carbonyl]- 4- phenylpyrrolidin- 2- one
Smiles: O=C1CC(CN1C(=O)c1ccccc1Cl)c1ccccc1

STK676938
Synonyms: (1E,2E)- 2- cyano- N- hydroxy- 2- (hydroxyimino)ethanimidoylchloride
Smiles: O/N=C(/C(=N\O)/Cl)\C#N

STK763934
Synonyms: methyl4- (3- acetyl- 6- amino- 5- cyano- 2- methyl- 4H- pyran- 4- yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C(=C(C)OC(=C1C#N)N)C(=O)C

STK676939
Synonyms: 3- methyl- 1,5- dinitro- 6- phenoxy- 3- azabicyclo[3.3.1]non- 6- ene
Smiles: CN1CC2(CC(C1)(CC=C2Oc1ccccc1)[N+](=O)[O-])[N+](=O)[O-]

STK763938
Synonyms: N- cyclopropyl- 3- (1H- indol- 3- yl)propanamide
Smiles: O=C(NC1CC1)CCc1c[nH]c2c1cccc2