Saturday, December 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-[(3-chloro-2-pyridyl)sulfanylmethyl]-8-methyl-imidazo[1,2-a]pyridine
CAS Name: 2-[[(3-chloro-2-pyridinyl)thio]methyl]-8-methylimidazo[1,2-a]pyridine
IUPAC NAME: 2-[(3-chloropyridin-2-yl)sulfanylmethyl]-8-methylimidazo[1,2-a]pyridine
SYSTEMATIC NAME: 2-[(3-chloranylpyridin-2-yl)sulfanylmethyl]-8-methyl-imidazo[1,2-a]pyridine
MOLECULAR FORMULA: C14H12ClN3S
MOLECULAR WEIGHT: 289.78318
SMILES: CC1=CC=CN2C1=NC(=C2)CSC3=C(C=CC=N3)Cl
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Product OPENEYE NAME: N-(4-methoxyphenyl)-2-[[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide
CAS Name: N-(4-methoxyphenyl)-2-[[1-oxo-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
IUPAC NAME: N-(4-methoxyphenyl)-2-[[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SYSTEMATIC NAME: N-(4-methoxyphenyl)-2-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
MOLECULAR FORMULA: C23H27N5O3S2
MOLECULAR WEIGHT: 485.62218
SMILES: CCCC1=NC(=NN1)SCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=C(C=C4)OC
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Product OPENEYE NAME: dimethyl 5-amino-3-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
CAS Name: 5-amino-3-[[(5-propyl-1H-1,2,4-triazol-3-yl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 5-amino-3-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 5-azanyl-3-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C14H18N4O4S2
MOLECULAR WEIGHT: 370.44712
SMILES: CCCC1=NC(=NN1)SCC2=C(SC(=C2C(=O)OC)N)C(=O)OC
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Product OPENEYE NAME: 8-methyl-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]imidazo[1,2-a]pyridine
CAS Name: 8-methyl-2-[[(5-propyl-1H-1,2,4-triazol-3-yl)thio]methyl]imidazo[1,2-a]pyridine
IUPAC NAME: 8-methyl-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]imidazo[1,2-a]pyridine
SYSTEMATIC NAME: 8-methyl-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]imidazo[1,2-a]pyridine
MOLECULAR FORMULA: C14H17N5S
MOLECULAR WEIGHT: 287.38328
SMILES: CCCC1=NC(=NN1)SCC2=CN3C=CC=C(C3=N2)C
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Product OPENEYE NAME: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate
CAS Name: 4-(1,2,4-triazol-1-ylmethyl)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-(1,2,4-triazol-1-ylmethyl)benzoate
SYSTEMATIC NAME: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate
MOLECULAR FORMULA: C17H13N5O3S
MOLECULAR WEIGHT: 367.38182
SMILES: C1=CC(=CC=C1CN2C=NC=N2)C(=O)OCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: 3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-5-(3-thienyl)-1,2,4-oxadiazole
CAS Name: 3-[[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-5-(3-thiophenyl)-1,2,4-oxadiazole
IUPAC NAME: 3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-5-thiophen-3-yl-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-5-thiophen-3-yl-1,2,4-oxadiazole
MOLECULAR FORMULA: C13H10N6OS2
MOLECULAR WEIGHT: 330.3881
SMILES: CN1C2=C(C=N1)C(=NC=N2)SCC3=NOC(=N3)C4=CSC=C4
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Product OPENEYE NAME: dimethyl 5-amino-3-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
CAS Name: 5-amino-3-[[(1-cyclopropyl-2-imidazolyl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 5-amino-3-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 5-azanyl-3-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C15H17N3O4S2
MOLECULAR WEIGHT: 367.44318
SMILES: COC(=O)C1=C(SC(=C1CSC2=NC=CN2C3CC3)C(=O)OC)N
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Product OPENEYE NAME: diethyl 5-amino-3-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
CAS Name: 5-amino-3-[[(1-cyclopropyl-2-imidazolyl)thio]methyl]thiophene-2,4-dicarboxylic acid diethyl ester
IUPAC NAME: diethyl 5-amino-3-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
SYSTEMATIC NAME: diethyl 5-azanyl-3-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C17H21N3O4S2
MOLECULAR WEIGHT: 395.49634
SMILES: CCOC(=O)C1=C(SC(=C1CSC2=NC=CN2C3CC3)C(=O)OCC)N
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Product OPENEYE NAME: 2-[4-[2-(1-cyclopropylimidazol-2-yl)sulfanylacetyl]piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
CAS Name: 2-[4-[2-[(1-cyclopropyl-2-imidazolyl)thio]-1-oxoethyl]-1-piperazinyl]-N-[2-(trifluoromethyl)phenyl]acetamide
IUPAC NAME: 2-[4-[2-(1-cyclopropylimidazol-2-yl)sulfanylacetyl]piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
SYSTEMATIC NAME: 2-[4-[2-(1-cyclopropylimidazol-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]ethanamide
MOLECULAR FORMULA: C21H24F3N5O2S
MOLECULAR WEIGHT: 467.50777
SMILES: C1CC1N2C=CN=C2SCC(=O)N3CCN(CC3)CC(=O)NC4=CC=CC=C4C(F)(F)F
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Product OPENEYE NAME: N,2,4,5-tetramethyl-N-[2-(3-methylphenoxy)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide
CAS Name: N,2,4,5-tetramethyl-N-[2-(3-methylphenoxy)ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide
IUPAC NAME: N,2,4,5-tetramethyl-N-[2-(3-methylphenoxy)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide
SYSTEMATIC NAME: N,2,4,5-tetramethyl-N-[2-(3-methylphenoxy)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide
MOLECULAR FORMULA: C20H23N3O2S
MOLECULAR WEIGHT: 369.48052
SMILES: CC1=CC(=CC=C1)OCCN(C)C(=O)C2=C(C3=C(N=C(N=C3S2)C)C)C
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Product OPENEYE NAME: N-(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)-1H-indazole-7-carboxamide
CAS Name: N-(1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)-1H-indazole-7-carboxamide
IUPAC NAME: N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-1H-indazole-7-carboxamide
SYSTEMATIC NAME: N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-1H-indazole-7-carboxamide
MOLECULAR FORMULA: C17H16N6O
MOLECULAR WEIGHT: 320.34854
SMILES: CC(C)N1C2=NC=C(C=C2C=N1)NC(=O)C3=CC=CC4=C3NN=C4
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Product OPENEYE NAME: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-ethyl] 6-methylpyridine-3-carboxylate
CAS Name: 6-methyl-3-pyridinecarboxylic acid [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] ester
IUPAC NAME: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] 6-methylpyridine-3-carboxylate
SYSTEMATIC NAME: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl] 6-methylpyridine-3-carboxylate
MOLECULAR FORMULA: C17H15NO5
MOLECULAR WEIGHT: 313.3047
SMILES: CC1=NC=C(C=C1)C(=O)OCC(=O)C2=CC3=C(C=C2)OCCO3
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Product OPENEYE NAME: [2-(4-chlorophenyl)-1-methyl-2-oxo-ethyl] 6-methylpyridine-3-carboxylate
CAS Name: 6-methyl-3-pyridinecarboxylic acid [1-(4-chlorophenyl)-1-oxopropan-2-yl] ester
IUPAC NAME: [1-(4-chlorophenyl)-1-oxopropan-2-yl] 6-methylpyridine-3-carboxylate
SYSTEMATIC NAME: [1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 6-methylpyridine-3-carboxylate
MOLECULAR FORMULA: C16H14ClNO3
MOLECULAR WEIGHT: 303.74026
SMILES: CC1=NC=C(C=C1)C(=O)OC(C)C(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: dimethyl 5-amino-3-[(6-methylpyridine-3-carbonyl)oxymethyl]thiophene-2,4-dicarboxylate
CAS Name: 5-amino-3-[[(6-methyl-3-pyridinyl)-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 5-amino-3-[(6-methylpyridine-3-carbonyl)oxymethyl]thiophene-2,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 5-azanyl-3-[(6-methylpyridin-3-yl)carbonyloxymethyl]thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C16H16N2O6S
MOLECULAR WEIGHT: 364.37304
SMILES: CC1=NC=C(C=C1)C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC
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Product OPENEYE NAME: [2-(5-fluoro-2-methoxy-phenyl)-2-oxo-ethyl] 6-methylpyridine-3-carboxylate
CAS Name: 6-methyl-3-pyridinecarboxylic acid [2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl] ester
IUPAC NAME: [2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl] 6-methylpyridine-3-carboxylate
SYSTEMATIC NAME: [2-(5-fluoranyl-2-methoxy-phenyl)-2-oxidanylidene-ethyl] 6-methylpyridine-3-carboxylate
MOLECULAR FORMULA: C16H14FNO4
MOLECULAR WEIGHT: 303.285063
SMILES: CC1=NC=C(C=C1)C(=O)OCC(=O)C2=C(C=CC(=C2)F)OC
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Product OPENEYE NAME: [2-[4-(2,2-dimethylpropanoylamino)phenyl]-1-methyl-2-oxo-ethyl] 6-methylpyridine-3-carboxylate
CAS Name: 6-methyl-3-pyridinecarboxylic acid [1-[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-1-oxopropan-2-yl] ester
IUPAC NAME: [1-[4-(2,2-dimethylpropanoylamino)phenyl]-1-oxopropan-2-yl] 6-methylpyridine-3-carboxylate
SYSTEMATIC NAME: [1-[4-(2,2-dimethylpropanoylamino)phenyl]-1-oxidanylidene-propan-2-yl] 6-methylpyridine-3-carboxylate
MOLECULAR FORMULA: C21H24N2O4
MOLECULAR WEIGHT: 368.42626
SMILES: CC1=NC=C(C=C1)C(=O)OC(C)C(=O)C2=CC=C(C=C2)NC(=O)C(C)(C)C
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