Saturday, December 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: dimethyl 5-amino-3-[[1-(m-tolyl)imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate
CAS Name: 5-amino-3-[[[1-(3-methylphenyl)-2-imidazolyl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 5-amino-3-[[1-(3-methylphenyl)imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 5-azanyl-3-[[1-(3-methylphenyl)imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C19H19N3O4S2
MOLECULAR WEIGHT: 417.50186
SMILES: CC1=CC(=CC=C1)N2C=CN=C2SCC3=C(SC(=C3C(=O)OC)N)C(=O)OC
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate
CAS Name: 5-cyclopropyl-2-phenyl-3-pyrazolecarboxylic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 5-cyclopropyl-2-phenylpyrazole-3-carboxylate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate
MOLECULAR FORMULA: C20H16N4O3S
MOLECULAR WEIGHT: 392.43104
SMILES: C1CC1C2=NN(C(=C2)C(=O)OCC3=NOC(=N3)C4=CSC=C4)C5=CC=CC=C5
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 3,4-dimethyl-5-sulfamoyl-benzoate
CAS Name: 3,4-dimethyl-5-sulfamoylbenzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3,4-dimethyl-5-sulfamoylbenzoate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3,4-dimethyl-5-sulfamoyl-benzoate
MOLECULAR FORMULA: C16H15N3O5S2
MOLECULAR WEIGHT: 393.4374
SMILES: CC1=C(C(=CC(=C1)C(=O)OCC2=NOC(=N2)C3=CSC=C3)S(=O)(=O)N)C
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carboxylate
CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinecarboxylic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxylate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxylate
MOLECULAR FORMULA: C19H16N4O4S2
MOLECULAR WEIGHT: 428.48474
SMILES: CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)OCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: dimethyl 5-amino-3-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]thiophene-2,4-dicarboxylate
CAS Name: 5-amino-3-[[[5-(trifluoromethyl)-2-pyridinyl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 5-amino-3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 5-azanyl-3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C15H13F3N2O4S2
MOLECULAR WEIGHT: 406.39993
SMILES: COC(=O)C1=C(SC(=C1CSC2=NC=C(C=C2)C(F)(F)F)C(=O)OC)N
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 7-fluoro-3-methyl-benzofuran-2-carboxylate
CAS Name: 7-fluoro-3-methyl-2-benzofurancarboxylic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 7-fluoro-3-methyl-1-benzofuran-2-carboxylate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 7-fluoranyl-3-methyl-1-benzofuran-2-carboxylate
MOLECULAR FORMULA: C17H11FN2O4S
MOLECULAR WEIGHT: 358.343643
SMILES: CC1=C(OC2=C1C=CC=C2F)C(=O)OCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: N,N-diethyl-4-[5-[[5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1,3,4-oxadiazol-2-yl]aniline
CAS Name: N,N-diethyl-4-[5-[[5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methylthio]-1,3,4-oxadiazol-2-yl]aniline
IUPAC NAME: N,N-diethyl-4-[5-[(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]aniline
SYSTEMATIC NAME: N,N-diethyl-4-[5-[(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]aniline
MOLECULAR FORMULA: C19H19N5O2S2
MOLECULAR WEIGHT: 413.51646
SMILES: CCN(CC)C1=CC=C(C=C1)C2=NN=C(O2)SCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: dimethyl 5-amino-3-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanylmethyl]thiophene-2,4-dicarboxylate
CAS Name: 5-amino-3-[[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 5-amino-3-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 5-azanyl-3-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C19H23N3O6S3
MOLECULAR WEIGHT: 485.59742
SMILES: COC(=O)C1=C(SC(=C1CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)OC)N
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Product OPENEYE NAME: 3-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanylmethyl]-5-(3-thienyl)-1,2,4-oxadiazole
CAS Name: 3-[[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]methyl]-5-(3-thiophenyl)-1,2,4-oxadiazole
IUPAC NAME: 3-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-5-thiophen-3-yl-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-5-thiophen-3-yl-1,2,4-oxadiazole
MOLECULAR FORMULA: C17H18N4O3S3
MOLECULAR WEIGHT: 422.54482
SMILES: C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 4-(cyclopropylsulfamoyl)benzoate
CAS Name: 4-(cyclopropylsulfamoyl)benzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-(cyclopropylsulfamoyl)benzoate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-(cyclopropylsulfamoyl)benzoate
MOLECULAR FORMULA: C17H15N3O5S2
MOLECULAR WEIGHT: 405.4481
SMILES: C1CC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 4-[(2,5-dioxopyrrolidin-1-yl)methyl]benzoate
CAS Name: 4-[(2,5-dioxo-1-pyrrolidinyl)methyl]benzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-[(2,5-dioxopyrrolidin-1-yl)methyl]benzoate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]methyl]benzoate
MOLECULAR FORMULA: C19H15N3O5S
MOLECULAR WEIGHT: 397.4045
SMILES: C1CC(=O)N(C1=O)CC2=CC=C(C=C2)C(=O)OCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 1-methylsulfonylindoline-5-carboxylate
CAS Name: 1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate
MOLECULAR FORMULA: C17H15N3O5S2
MOLECULAR WEIGHT: 405.4481
SMILES: CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)OCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: dimethyl 5-amino-3-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]thiophene-2,4-dicarboxylate
CAS Name: 5-amino-3-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 5-amino-3-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 5-azanyl-3-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C18H21N3O6S3
MOLECULAR WEIGHT: 471.57084
SMILES: COC(=O)C1=C(SC(=C1CSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)OC)N
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Product OPENEYE NAME: 5-(4-fluorophenyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one
CAS Name: 5-(4-fluorophenyl)-2-[(8-methyl-2-imidazo[1,2-a]pyridinyl)methylthio]-3H-thieno[2,3-d]pyrimidin-4-one
IUPAC NAME: 5-(4-fluorophenyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 5-(4-fluorophenyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C21H15FN4OS2
MOLECULAR WEIGHT: 422.498403
SMILES: CC1=CC=CN2C1=NC(=C2)CSC3=NC4=C(C(=CS4)C5=CC=C(C=C5)F)C(=O)N3
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Product OPENEYE NAME: 3-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(3-thienyl)-1,2,4-oxadiazole
CAS Name: 3-[[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-5-(3-thiophenyl)-1,2,4-oxadiazole
IUPAC NAME: 3-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-thiophen-3-yl-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-thiophen-3-yl-1,2,4-oxadiazole
MOLECULAR FORMULA: C17H14N6OS2
MOLECULAR WEIGHT: 382.46266
SMILES: C1CC1N2C(=NN=C2SCC3=NOC(=N3)C4=CSC=C4)C5=CN=CC=C5
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 3-[methoxy(methyl)sulfamoyl]benzoate
CAS Name: 3-[methoxy(methyl)sulfamoyl]benzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3-[methoxy(methyl)sulfamoyl]benzoate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3-[methoxy(methyl)sulfamoyl]benzoate
MOLECULAR FORMULA: C16H15N3O6S2
MOLECULAR WEIGHT: 409.4368
SMILES: CN(OC)S(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=NOC(=N2)C3=CSC=C3
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Product OPENEYE NAME: 3-[[5-(1-piperidyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(3-thienyl)-1,2,4-oxadiazole
CAS Name: 3-[[[4-(4-methylphenyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]methyl]-5-(3-thiophenyl)-1,2,4-oxadiazole
IUPAC NAME: 3-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-3-yl-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-3-yl-1,2,4-oxadiazole
MOLECULAR FORMULA: C21H22N6OS2
MOLECULAR WEIGHT: 438.56898
SMILES: CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NOC(=N3)C4=CSC=C4)N5CCCCC5
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 2H-chromene-3-carboxylate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C17H12N2O4S
MOLECULAR WEIGHT: 340.35318
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: N-[2-[(2-fluoro-4-methyl-phenyl)carbamoyl]phenyl]thiophene-2-carboxamide
CAS Name: N-[2-[(2-fluoro-4-methylanilino)-oxomethyl]phenyl]-2-thiophenecarboxamide
IUPAC NAME: N-[2-[(2-fluoro-4-methylphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[2-[(2-fluoranyl-4-methyl-phenyl)carbamoyl]phenyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C19H15FN2O2S
MOLECULAR WEIGHT: 354.398003
SMILES: CC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC=CS3)F
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Product OPENEYE NAME: N-[2-[(2-fluoro-5-methyl-phenyl)carbamoyl]phenyl]thiophene-2-carboxamide
CAS Name: N-[2-[(2-fluoro-5-methylanilino)-oxomethyl]phenyl]-2-thiophenecarboxamide
IUPAC NAME: N-[2-[(2-fluoro-5-methylphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[2-[(2-fluoranyl-5-methyl-phenyl)carbamoyl]phenyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C19H15FN2O2S
MOLECULAR WEIGHT: 354.398003
SMILES: CC1=CC(=C(C=C1)F)NC(=O)C2=CC=CC=C2NC(=O)C3=CC=CS3
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 3-(ethoxycarbonylamino)benzoate
CAS Name: 3-(ethoxycarbonylamino)benzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3-(ethoxycarbonylamino)benzoate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3-(ethoxycarbonylamino)benzoate
MOLECULAR FORMULA: C17H15N3O5S
MOLECULAR WEIGHT: 373.3831
SMILES: CCOC(=O)NC1=CC=CC(=C1)C(=O)OCC2=NOC(=N2)C3=CSC=C3
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 5-acetylthiophene-2-carboxylate
CAS Name: 5-acetyl-2-thiophenecarboxylic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 5-acetylthiophene-2-carboxylate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 5-ethanoylthiophene-2-carboxylate
MOLECULAR FORMULA: C14H10N2O4S2
MOLECULAR WEIGHT: 334.3702
SMILES: CC(=O)C1=CC=C(S1)C(=O)OCC2=NOC(=N2)C3=CSC=C3
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 4-bromo-3,5-dimethoxy-benzoate
CAS Name: 4-bromo-3,5-dimethoxybenzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester
IUPAC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-bromo-3,5-dimethoxybenzoate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-bromanyl-3,5-dimethoxy-benzoate
MOLECULAR FORMULA: C16H13BrN2O5S
MOLECULAR WEIGHT: 425.25382
SMILES: COC1=CC(=CC(=C1Br)OC)C(=O)OCC2=NOC(=N2)C3=CSC=C3
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