CAS RN: 7026-79-1
CAS Name: 3-[(2-chlorophenyl)methyl]-5-[[2-(2-hydroxyethylamino)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 3-[(2-chlorophenyl)methyl]-5-[[2-(2-hydroxyethylamino)-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-2-thioxo-thiazolidin-4-one
IUPAC Name: 3-[(2-chlorophenyl)methyl]-5-[[2-(2-hydroxyethylamino)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 3-[(2-chlorophenyl)methyl]-5-[[2-(2-hydroxyethylamino)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C22H19ClN4O3S2
MOLECULAR WEIGHT: 486.99426
SMILES: CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4Cl)NCCO
Structure:
CAS RN: 7038-11-1
CAS Name: 4-(4-chlorophenyl)sulfonyl-2-(4-fluorophenyl)-N-(phenylmethyl)-5-oxazolamine
OPENEYE Name: N-benzyl-4-(4-chlorophenyl)sulfonyl-2-(4-fluorophenyl)oxazol-5-amine
IUPAC Name: N-benzyl-4-(4-chlorophenyl)sulfonyl-2-(4-fluorophenyl)-1,3-oxazol-5-amine
SYSTEMATIC NAME: 4-(4-chlorophenyl)sulfonyl-2-(4-fluorophenyl)-N-(phenylmethyl)-1,3-oxazol-5-amine
MOLECULAR FORMULA: C22H16ClFN2O3S
MOLECULAR WEIGHT: 442.890443
SMILES: C1=CC=C(C=C1)CNC2=C(N=C(O2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)Cl
Structure:
CAS RN: 7038-10-0
CAS Name: N-[(4-chlorophenyl)-[[(4-methoxyphenyl)-oxomethyl]amino]methyl]-4-methoxybenzamide
OPENEYE Name: N-[(4-chlorophenyl)-[(4-methoxybenzoyl)amino]methyl]-4-methoxy-benzamide
IUPAC Name: N-[(4-chlorophenyl)-[(4-methoxybenzoyl)amino]methyl]-4-methoxybenzamide
SYSTEMATIC NAME: N-[(4-chlorophenyl)-[(4-methoxyphenyl)carbonylamino]methyl]-4-methoxy-benzamide
MOLECULAR FORMULA: C23H21ClN2O4
MOLECULAR WEIGHT: 424.87684
SMILES: COC1=CC=C(C=C1)C(=O)NC(C2=CC=C(C=C2)Cl)NC(=O)C3=CC=C(C=C3)OC
Structure:
CAS RN: 7038-09-7
CAS Name: N-[[[2-furanyl(oxo)methyl]amino]-(3-methoxy-4-propoxyphenyl)methyl]-2-furancarboxamide
OPENEYE Name: N-[(furan-2-carbonylamino)-(3-methoxy-4-propoxy-phenyl)methyl]furan-2-carboxamide
IUPAC Name: N-[(furan-2-carbonylamino)-(3-methoxy-4-propoxyphenyl)methyl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(furan-2-ylcarbonylamino)-(3-methoxy-4-propoxy-phenyl)methyl]furan-2-carboxamide
MOLECULAR FORMULA: C21H22N2O6
MOLECULAR WEIGHT: 398.40918
SMILES: CCCOC1=C(C=C(C=C1)C(NC(=O)C2=CC=CO2)NC(=O)C3=CC=CO3)OC
Structure:
CAS RN: 6769-44-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H18N4O3
MOLECULAR WEIGHT: 374.39262
SMILES: CC1=CC=CN2C1=NC3=C(C2=O)C=C(N3C)C(=O)NC4=CC=C(C=C4)C(=O)C
Structure:
CAS RN: 6007-39-2
CAS Name: N-tert-butyl-N-[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]octanamide
OPENEYE Name: N-tert-butyl-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]octanamide
IUPAC Name: N-tert-butyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]octanamide
SYSTEMATIC NAME: N-tert-butyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]octanamide
MOLECULAR FORMULA: C19H33N3O2S
MOLECULAR WEIGHT: 367.54922
SMILES: CCCCCCCC(=O)N(CC(=O)NC1=NC(=C(S1)C)C)C(C)(C)C
Structure:
CAS RN: 6036-16-4
CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(phenylmethyl)-3-thiazolidinecarboxamide
OPENEYE Name: 2-(1,3-benzodioxol-5-yl)-N-benzyl-thiazolidine-3-carboxamide
IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-benzyl-1,3-thiazolidine-3-carboxamide
SYSTEMATIC NAME: 2-(1,3-benzodioxol-5-yl)-N-(phenylmethyl)-1,3-thiazolidine-3-carboxamide
MOLECULAR FORMULA: C18H18N2O3S
MOLECULAR WEIGHT: 342.41212
SMILES: C1CSC(N1C(=O)NCC2=CC=CC=C2)C3=CC4=C(C=C3)OCO4
Structure:
CAS RN: 6600-41-5
CAS Name: 3-[2,4-bis(difluoromethoxy)phenyl]-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)-2-propenenitrile
OPENEYE Name: 3-[2,4-bis(difluoromethoxy)phenyl]-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)prop-2-enenitrile
IUPAC Name: 3-[2,4-bis(difluoromethoxy)phenyl]-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)prop-2-enenitrile
SYSTEMATIC NAME: 3-[2,4-bis[bis(fluoranyl)methoxy]phenyl]-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)prop-2-enenitrile
MOLECULAR FORMULA: C18H16F4N4O2
MOLECULAR WEIGHT: 396.338853
SMILES: C1CCC2=NN=C(N2CC1)C(=CC3=C(C=C(C=C3)OC(F)F)OC(F)F)C#N
Structure:
CAS RN: 77168-22-0
CAS Name: 1-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]amino]-3-butylthiourea
OPENEYE Name: 1-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-3-butyl-thiourea
IUPAC Name: 1-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-3-butylthiourea
SYSTEMATIC NAME: 1-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-3-butyl-thiourea
MOLECULAR FORMULA: C14H19N5OS2
MOLECULAR WEIGHT: 337.46356
SMILES: CCCCNC(=S)NNC(=O)CSC1=NC2=CC=CC=C2N1
Structure:
CAS RN: 5222-53-7
CAS Name: N'-hydroxy-N-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]pentanediamide
OPENEYE Name: 5-(hydroxyamino)-N-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]-5-oxo-pentanamide
IUPAC Name: N'-hydroxy-N-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]pentanediamide
SYSTEMATIC NAME: N-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]-N'-oxidanyl-pentanediamide
MOLECULAR FORMULA: C40H45N5O8
MOLECULAR WEIGHT: 723.814
SMILES: C1CN(CCN1CC2CC(OC(O2)C3=CC=C(C=C3)C4=CC(=CC=C4)CNC(=O)CCCC(=O)NO)C5=CC=C(C=C5)CO)C6=CC=C(C=C6)[N+](=O)[O-]
Structure:
CAS RN: 6457-29-0
CAS Name: 2-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
OPENEYE Name: ethyl 2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
IUPAC Name: ethyl 2-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methylidene]-7-methyl-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C24H26N4O3S
MOLECULAR WEIGHT: 450.55324
SMILES: CCN1C(=C(C(=N1)C)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC=CC=C4)C
Structure:
CAS RN: 6452-38-6
CAS Name: 2-(4-bromoanilino)-N-[[2-[(4-bromophenyl)methoxy]phenyl]methylideneamino]butanamide
OPENEYE Name: 2-(4-bromoanilino)-N-[[2-[(4-bromophenyl)methoxy]phenyl]methyleneamino]butanamide
IUPAC Name: 2-(4-bromoanilino)-N-[[2-[(4-bromophenyl)methoxy]phenyl]methylideneamino]butanamide
SYSTEMATIC NAME: 2-[(4-bromophenyl)amino]-N-[[2-[(4-bromophenyl)methoxy]phenyl]methylideneamino]butanamide
MOLECULAR FORMULA: C24H23Br2N3O2
MOLECULAR WEIGHT: 545.26632
SMILES: CCC(C(=O)NN=CC1=CC=CC=C1OCC2=CC=C(C=C2)Br)NC3=CC=C(C=C3)Br
Structure:
CAS RN: 6068-21-9
CAS Name: 4-[8-(3-chlorophenyl)-6-(2-hydroxy-3-methylphenyl)-1,3,7,9-tetraoxo-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]butanoic acid
OPENEYE Name: 4-[8-(3-chlorophenyl)-6-(2-hydroxy-3-methyl-phenyl)-1,3,7,9-tetraoxo-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]butanoic acid
IUPAC Name: 4-[8-(3-chlorophenyl)-6-(2-hydroxy-3-methylphenyl)-1,3,7,9-tetraoxo-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]butanoic acid
SYSTEMATIC NAME: 4-[8-(3-chlorophenyl)-6-(3-methyl-2-oxidanyl-phenyl)-1,3,7,9-tetrakis(oxidanylidene)-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]butanoic acid
MOLECULAR FORMULA: C37H33ClN2O7
MOLECULAR WEIGHT: 653.12012
SMILES: CC1=CC=CC(=C1O)C2C3=CCC4C(C3CC5C2(C(=O)N(C5=O)C6=CC(=CC=C6)Cl)C7=CC=CC=C7)C(=O)N(C4=O)CCCC(=O)O
Structure:
CAS RN: 5298-92-0
CAS Name: 2'-[(3-methoxyphenyl)-oxomethyl]-5'-methyl-1'-[oxo(thiophen-2-yl)methyl]-2-spiro[1H-indole-3,3'-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline]one
OPENEYE Name: 2-(3-methoxybenzoyl)-5-methyl-1-(thiophene-2-carbonyl)spiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,3'-indoline]-2'-one
IUPAC Name: 2'-(3-methoxybenzoyl)-5'-methyl-1'-(thiophene-2-carbonyl)spiro[1H-indole-3,3'-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline]-2-one
SYSTEMATIC NAME: 2'-(3-methoxyphenyl)carbonyl-5'-methyl-1'-thiophen-2-ylcarbonyl-spiro[1H-indole-3,3'-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline]-2-one
MOLECULAR FORMULA: C33H26N2O4S
MOLECULAR WEIGHT: 546.63554
SMILES: CC1=CC2C3(C(C(N2C4=CC=CC=C14)C(=O)C5=CC=CS5)C(=O)C6=CC(=CC=C6)OC)C7=CC=CC=C7NC3=O
Structure:
CAS RN: 6483-79-0
CAS Name: 6-[[5-(4-methylphenyl)-2-pyrimidinyl]oxy]-3,4-dihydro-2H-naphthalen-1-one
OPENEYE Name: 6-[5-(p-tolyl)pyrimidin-2-yl]oxytetralin-1-one
IUPAC Name: 6-[5-(4-methylphenyl)pyrimidin-2-yl]oxy-3,4-dihydro-2H-naphthalen-1-one
SYSTEMATIC NAME: 6-[5-(4-methylphenyl)pyrimidin-2-yl]oxy-3,4-dihydro-2H-naphthalen-1-one
MOLECULAR FORMULA: C21H18N2O2
MOLECULAR WEIGHT: 330.37982
SMILES: CC1=CC=C(C=C1)C2=CN=C(N=C2)OC3=CC4=C(C=C3)C(=O)CCC4
Structure:
CAS RN: 6375-77-5
CAS Name: N,N'-dipropylhexanediamide
OPENEYE Name: N,N'-dipropylhexanediamide
IUPAC Name: N,N'-dipropylhexanediamide
SYSTEMATIC NAME: N,N'-dipropylhexanediamide
MOLECULAR FORMULA: C12H24N2O2
MOLECULAR WEIGHT: 228.33116
SMILES: CCCNC(=O)CCCCC(=O)NCCC
Structure:
CAS RN: 6372-71-0
CAS Name: 2-(3,4-dimethoxyphenyl)-N-[3-[4-[3-[[[2-(3,4-dimethoxyphenyl)-4-quinolinyl]-oxomethyl]amino]propyl]-1-piperazinyl]propyl]-4-quinolinecarboxamide
OPENEYE Name: 2-(3,4-dimethoxyphenyl)-N-[3-[4-[3-[[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide
IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[3-[4-[3-[[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide
SYSTEMATIC NAME: 2-(3,4-dimethoxyphenyl)-N-[3-[4-[3-[[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonylamino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide
MOLECULAR FORMULA: C46H50N6O6
MOLECULAR WEIGHT: 782.9258
SMILES: COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCN(CC4)CCCNC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC(=C(C=C7)OC)OC)OC
Structure:
CAS RN: 6801-62-3
CAS Name: N-(2,2-dimethoxyethyl)-6-[methyl-(2-methylphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide
OPENEYE Name: N-(2,2-dimethoxyethyl)-6-[methyl(o-tolyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide
IUPAC Name: N-(2,2-dimethoxyethyl)-6-[methyl-(2-methylphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide
SYSTEMATIC NAME: N-(2,2-dimethoxyethyl)-6-[methyl-(2-methylphenyl)sulfamoyl]-4-oxidanylidene-1H-quinoline-3-carboxamide
MOLECULAR FORMULA: C22H25N3O6S
MOLECULAR WEIGHT: 459.5154
SMILES: CC1=CC=CC=C1N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCC(OC)OC
Structure:
CAS RN: 5302-06-7
CAS Name: 4-methyl-3-[[1-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]amino]-1H-indole-2-carboxylic acid methyl ester
OPENEYE Name: methyl 4-methyl-3-[[2-[4-(2-pyridyl)piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate
IUPAC Name: methyl 4-methyl-3-[[2-(4-pyridin-2-ylpiperazin-1-yl)acetyl]amino]-1H-indole-2-carboxylate
SYSTEMATIC NAME: methyl 4-methyl-3-[2-(4-pyridin-2-ylpiperazin-1-yl)ethanoylamino]-1H-indole-2-carboxylate
MOLECULAR FORMULA: C22H25N5O3
MOLECULAR WEIGHT: 407.4656
SMILES: CC1=C2C(=CC=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=CC=N4)C(=O)OC
Structure:
CAS RN: 5961-95-5
CAS Name: 3-[[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-N-(3,3-diphenylpropyl)propanamide
OPENEYE Name: 3-[[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-isopropyl-amino]-N-(3,3-diphenylpropyl)propanamide
IUPAC Name: 3-[[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-N-(3,3-diphenylpropyl)propanamide
SYSTEMATIC NAME: 3-[[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]-N-(3,3-diphenylpropyl)propanamide
MOLECULAR FORMULA: C30H33ClN4OS
MOLECULAR WEIGHT: 533.12722
SMILES: CC(C)N(CCC(=O)NCCC(C1=CC=CC=C1)C2=CC=CC=C2)C3=NC(=NS3)CC4=CC=C(C=C4)Cl
Structure:
CAS RN: 5961-34-2
CAS Name: 1-[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-[2-(2,4-dichlorophenyl)ethyl]-4-piperidinecarboxamide
OPENEYE Name: 1-[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-[2-(2,4-dichlorophenyl)ethyl]piperidine-4-carboxamide
IUPAC Name: 1-[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-[2-(2,4-dichlorophenyl)ethyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-[2-(2,4-dichlorophenyl)ethyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C23H23Cl3N4OS
MOLECULAR WEIGHT: 509.87892
SMILES: C1CN(CCC1C(=O)NCCC2=C(C=C(C=C2)Cl)Cl)C3=NC(=NS3)CC4=CC=C(C=C4)Cl
Structure:
CAS RN: 5957-66-4
CAS Name: 1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-cyclohexyl-1-(3-methoxypropyl)urea
OPENEYE Name: 1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]-3-cyclohexyl-1-(3-methoxypropyl)urea
IUPAC Name: 1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-cyclohexyl-1-(3-methoxypropyl)urea
SYSTEMATIC NAME: 1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-3-cyclohexyl-1-(3-methoxypropyl)urea
MOLECULAR FORMULA: C26H34ClN3O3S
MOLECULAR WEIGHT: 504.08446
SMILES: COCCCN(CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)Cl)C=CS2)C(=O)NC4CCCCC4
Structure:
CAS RN: 5957-05-1
CAS Name: 3,4-dichloro-N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(2-methylpropyl)benzamide
OPENEYE Name: 3,4-dichloro-N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]-N-isobutyl-benzamide
IUPAC Name: 3,4-dichloro-N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(2-methylpropyl)benzamide
SYSTEMATIC NAME: 3,4-bis(chloranyl)-N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)benzamide
MOLECULAR FORMULA: C26H25Cl3N2O2S
MOLECULAR WEIGHT: 535.9129
SMILES: CC(C)CN(CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)Cl)C=CS2)C(=O)C4=CC(=C(C=C4)Cl)Cl
Structure:
CAS RN: 5620-03-1
CAS Name: 1-methyl-9H-pyrano[3,4-b]indol-3-one
OPENEYE Name: 1-methyl-9H-pyrano[3,4-b]indol-3-one
IUPAC Name: 1-methyl-9H-pyrano[3,4-b]indol-3-one
SYSTEMATIC NAME: 1-methyl-9H-pyrano[3,4-b]indol-3-one
MOLECULAR FORMULA: C12H9NO2
MOLECULAR WEIGHT: 199.20536
SMILES: CC1=C2C(=CC(=O)O1)C3=CC=CC=C3N2
Structure:
CAS RN: 5616-96-6
CAS Name: 3-[5-(diethylsulfamoyl)-1-ethyl-2-benzimidazolyl]-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]propanamide
OPENEYE Name: 3-[5-(diethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide
IUPAC Name: 3-[5-(diethylsulfamoyl)-1-ethylbenzimidazol-2-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide
SYSTEMATIC NAME: 3-[5-(diethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide
MOLECULAR FORMULA: C20H28N6O3S3
MOLECULAR WEIGHT: 496.66972
SMILES: CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1CCC(=O)NC3=NN=C(S3)SCC
Structure:
CAS RN: 5616-35-3
CAS Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]acetamide
OPENEYE Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]acetamide
IUPAC Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide
SYSTEMATIC NAME: 2-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]ethanamide
MOLECULAR FORMULA: C19H16N4O7S2
MOLECULAR WEIGHT: 476.48294
SMILES: C1C=CCC2C1C(=O)N(C2=O)CC(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]
Structure:
CAS RN: 5845-40-9
CAS Name: N-[bis(4-methoxyphenyl)methylideneamino]-1-methyl-2-indolecarboxamide
OPENEYE Name: N-[bis(4-methoxyphenyl)methyleneamino]-1-methyl-indole-2-carboxamide
IUPAC Name: N-[bis(4-methoxyphenyl)methylideneamino]-1-methylindole-2-carboxamide
SYSTEMATIC NAME: N-[bis(4-methoxyphenyl)methylideneamino]-1-methyl-indole-2-carboxamide
MOLECULAR FORMULA: C25H23N3O3
MOLECULAR WEIGHT: 413.46842
SMILES: CN1C2=CC=CC=C2C=C1C(=O)NN=C(C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC
Structure:
CAS RN: 6134-49-2
CAS Name: 4-chloro-N-[5-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-4-oxo-3-(phenylmethyl)-2-sulfanylidene-1-imidazolidinyl]benzamide
OPENEYE Name: N-[3-benzyl-5-[2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl]-4-oxo-2-thioxo-imidazolidin-1-yl]-4-chloro-benzamide
IUPAC Name: N-[3-benzyl-5-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-4-oxo-2-sulfanylideneimidazolidin-1-yl]-4-chlorobenzamide
SYSTEMATIC NAME: 4-chloranyl-N-[5-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-imidazolidin-1-yl]benzamide
MOLECULAR FORMULA: C26H22Cl2N4O3S
MOLECULAR WEIGHT: 541.44888
SMILES: CC1=C(C=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2NC(=O)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4)Cl
Structure:
CAS RN: 5826-37-9
CAS Name: 3-ethyl-5-[[3-iodo-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 3-ethyl-5-[[3-iodo-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]methylene]-2-thioxo-thiazolidin-4-one
IUPAC Name: 3-ethyl-5-[[3-iodo-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 3-ethyl-5-[[3-iodanyl-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C22H22INO4S2
MOLECULAR WEIGHT: 555.44885
SMILES: CCN1C(=O)C(=CC2=CC(=C(C(=C2)I)OCCOC3=CC=CC=C3C)OC)SC1=S
Structure:
CAS RN: 6809-49-0
CAS Name: 3-(3-chloro-4-fluorophenyl)-1-[2-(4-chlorophenyl)ethyl]-1-[[1-[(2,4-dimethylphenyl)methyl]-2-pyrrolyl]methyl]thiourea
OPENEYE Name: 3-(3-chloro-4-fluoro-phenyl)-1-[2-(4-chlorophenyl)ethyl]-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]thiourea
IUPAC Name: 3-(3-chloro-4-fluorophenyl)-1-[2-(4-chlorophenyl)ethyl]-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]thiourea
SYSTEMATIC NAME: 3-(3-chloranyl-4-fluoranyl-phenyl)-1-[2-(4-chlorophenyl)ethyl]-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]thiourea
MOLECULAR FORMULA: C29H28Cl2FN3S
MOLECULAR WEIGHT: 540.522123
SMILES: CC1=CC(=C(C=C1)CN2C=CC=C2CN(CCC3=CC=C(C=C3)Cl)C(=S)NC4=CC(=C(C=C4)F)Cl)C
Structure:
CAS RN: 6809-48-9
CAS Name: 1-[2-(4-chlorophenyl)ethyl]-1-[[1-[(2,4-dimethylphenyl)methyl]-2-pyrrolyl]methyl]-3-(2-methylphenyl)thiourea
OPENEYE Name: 1-[2-(4-chlorophenyl)ethyl]-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(o-tolyl)thiourea
IUPAC Name: 1-[2-(4-chlorophenyl)ethyl]-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(2-methylphenyl)thiourea
SYSTEMATIC NAME: 1-[2-(4-chlorophenyl)ethyl]-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(2-methylphenyl)thiourea
MOLECULAR FORMULA: C30H32ClN3S
MOLECULAR WEIGHT: 502.11318
SMILES: CC1=CC(=C(C=C1)CN2C=CC=C2CN(CCC3=CC=C(C=C3)Cl)C(=S)NC4=CC=CC=C4C)C
Structure:
CAS RN: 5611-44-9
CAS Name: carbonic acid butyl (5-chloro-2-oxo-1,3-benzoxathiol-6-yl) ester
OPENEYE Name: butyl (5-chloro-2-oxo-1,3-benzoxathiol-6-yl) carbonate
IUPAC Name: butyl (5-chloro-2-oxo-1,3-benzoxathiol-6-yl) carbonate
SYSTEMATIC NAME: butyl (5-chloranyl-2-oxidanylidene-1,3-benzoxathiol-6-yl) carbonate
MOLECULAR FORMULA: C12H11ClO5S
MOLECULAR WEIGHT: 302.73074
SMILES: CCCCOC(=O)OC1=C(C=C2C(=C1)OC(=O)S2)Cl
Structure:
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