Tuesday, May 7, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (E)-3-[5-(4-fluorophenyl)-2-thienyl]-N-(2-methoxyethyl)prop-2-enamide
CAS Name: (E)-3-[5-(4-fluorophenyl)-2-thiophenyl]-N-(2-methoxyethyl)-2-propenamide
IUPAC NAME: (E)-3-[5-(4-fluorophenyl)thiophen-2-yl]-N-(2-methoxyethyl)prop-2-enamide
SYSTEMATIC NAME: (E)-3-[5-(4-fluorophenyl)thiophen-2-yl]-N-(2-methoxyethyl)prop-2-enamide
MOLECULAR FORMULA: C16H16FNO2S
MOLECULAR WEIGHT: 305.367143
SMILES: COCCNC(=O)/C=C/C1=CC=C(S1)C2=CC=C(C=C2)F
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Product OPENEYE NAME: (2S)-1-(4-bromophenyl)sulfonyl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-1-(4-bromophenyl)sulfonyl-N-(2-methoxyethyl)-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-1-(4-bromophenyl)sulfonyl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-1-(4-bromophenyl)sulfonyl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C14H19BrN2O4S
MOLECULAR WEIGHT: 391.28066
SMILES: COCCNC(=O)[C@@H]1CCCN1S(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: (2R)-1-(4-bromophenyl)sulfonyl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
CAS Name: (2R)-1-(4-bromophenyl)sulfonyl-N-(2-methoxyethyl)-2-pyrrolidinecarboxamide
IUPAC NAME: (2R)-1-(4-bromophenyl)sulfonyl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2R)-1-(4-bromophenyl)sulfonyl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C14H19BrN2O4S
MOLECULAR WEIGHT: 391.28066
SMILES: COCCNC(=O)[C@H]1CCCN1S(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-3-(3,5-dimethylisoxazol-4-yl)propanamide
CAS Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-3-(3,5-dimethyl-4-isoxazolyl)propanamide
IUPAC NAME: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
SYSTEMATIC NAME: N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
MOLECULAR FORMULA: C16H16ClN5O2
MOLECULAR WEIGHT: 345.78354
SMILES: CC1=C(C(=NO1)C)CCC(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3
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Product OPENEYE NAME: (2-hydroxy-5-methoxy-phenyl)-pyrrolidin-1-yl-methanone
CAS Name: (2-hydroxy-5-methoxyphenyl)-(1-pyrrolidinyl)methanone
IUPAC NAME: (2-hydroxy-5-methoxyphenyl)-pyrrolidin-1-ylmethanone
SYSTEMATIC NAME: (5-methoxy-2-oxidanyl-phenyl)-pyrrolidin-1-yl-methanone
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 221.2524
SMILES: COC1=CC(=C(C=C1)O)C(=O)N2CCCC2
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Product OPENEYE NAME: 1-(4-benzhydrylpiperazin-1-yl)-3-(1,3,4,6-tetramethylpyrazolo[3,4-b]pyridin-5-yl)propan-1-one
CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-(1,3,4,6-tetramethyl-5-pyrazolo[3,4-b]pyridinyl)-1-propanone
IUPAC NAME: 1-(4-benzhydrylpiperazin-1-yl)-3-(1,3,4,6-tetramethylpyrazolo[3,4-b]pyridin-5-yl)propan-1-one
SYSTEMATIC NAME: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-(1,3,4,6-tetramethylpyrazolo[3,4-b]pyridin-5-yl)propan-1-one
MOLECULAR FORMULA: C30H35N5O
MOLECULAR WEIGHT: 481.6318
SMILES: CC1=C2C(=NN(C2=NC(=C1CCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C)C)C
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Product OPENEYE NAME: methyl 2-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
CAS Name: 2-[[4-(4-nitrophenyl)-1-piperazin-1-iumyl]methyl]-8-imidazo[1,2-a]pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
SYSTEMATIC NAME: methyl 2-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
MOLECULAR FORMULA: C20H22N5O4+
MOLECULAR WEIGHT: 396.41978
SMILES: COC(=O)C1=CC=CN2C1=NC(=C2)C[NH+]3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: methyl 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
CAS Name: 2-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-8-imidazo[1,2-a]pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
SYSTEMATIC NAME: methyl 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
MOLECULAR FORMULA: C20H21N5O4
MOLECULAR WEIGHT: 395.41184
SMILES: COC(=O)C1=CC=CN2C1=NC(=C2)CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: methyl 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
CAS Name: 2-[[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-8-imidazo[1,2-a]pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
SYSTEMATIC NAME: methyl 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
MOLECULAR FORMULA: C21H21F3N4O4S
MOLECULAR WEIGHT: 482.47605
SMILES: COC(=O)C1=CC=CN2C1=NC(=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F
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Product OPENEYE NAME: N,N-diethylimidazo[1,2-a]pyridine-2-carboxamide
CAS Name: N,N-diethyl-2-imidazo[1,2-a]pyridinecarboxamide
IUPAC NAME: N,N-diethylimidazo[1,2-a]pyridine-2-carboxamide
SYSTEMATIC NAME: N,N-diethylimidazo[1,2-a]pyridine-2-carboxamide
MOLECULAR FORMULA: C12H15N3O
MOLECULAR WEIGHT: 217.267
SMILES: CCN(CC)C(=O)C1=CN2C=CC=CC2=N1
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Product OPENEYE NAME: N,N-diethyl-5-methyl-imidazo[1,2-a]pyridine-2-carboxamide
CAS Name: N,N-diethyl-5-methyl-2-imidazo[1,2-a]pyridinecarboxamide
IUPAC NAME: N,N-diethyl-5-methylimidazo[1,2-a]pyridine-2-carboxamide
SYSTEMATIC NAME: N,N-diethyl-5-methyl-imidazo[1,2-a]pyridine-2-carboxamide
MOLECULAR FORMULA: C13H17N3O
MOLECULAR WEIGHT: 231.29358
SMILES: CCN(CC)C(=O)C1=CN2C(=CC=CC2=N1)C
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Product OPENEYE NAME: methyl 5-(diethylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate
CAS Name: 5-[diethylamino(oxo)methyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester
IUPAC NAME: methyl 5-(diethylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate
SYSTEMATIC NAME: methyl 5-(diethylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate
MOLECULAR FORMULA: C14H22N2O3
MOLECULAR WEIGHT: 266.33608
SMILES: CCC1=C(C(=C(N1)C(=O)N(CC)CC)C)C(=O)OC
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Product OPENEYE NAME: 2-[[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-methyl-ammonio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanimidate
CAS Name: 2-[[2-(3,4-diethoxyanilino)-2-oxoethyl]-methylammonio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanimidate
IUPAC NAME: 2-[[2-(3,4-diethoxyanilino)-2-oxoethyl]-methylazaniumyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanimidate
SYSTEMATIC NAME: 2-[[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azaniumyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanimidate
MOLECULAR FORMULA: C18H25N5O4S
MOLECULAR WEIGHT: 407.4872
SMILES: CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CC(=NC2=NN=C(S2)C)[O-])OCC
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Product OPENEYE NAME: N-(3,4-diethoxyphenyl)-2-[methyl-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethyl]amino]acetamide
CAS Name: N-(3,4-diethoxyphenyl)-2-[methyl-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]amino]acetamide
IUPAC NAME: N-(3,4-diethoxyphenyl)-2-[methyl-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]amino]acetamide
SYSTEMATIC NAME: N-(3,4-diethoxyphenyl)-2-[methyl-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxidanylidene-ethyl]amino]ethanamide
MOLECULAR FORMULA: C18H25N5O4S
MOLECULAR WEIGHT: 407.4872
SMILES: CCOC1=C(C=C(C=C1)NC(=O)CN(C)CC(=O)NC2=NN=C(S2)C)OCC
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Product OPENEYE NAME: methyl 2-[[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
CAS Name: 2-[[4-(2-cyanophenyl)sulfonyl-1-piperazinyl]methyl]-8-imidazo[1,2-a]pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
SYSTEMATIC NAME: methyl 2-[[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate
MOLECULAR FORMULA: C21H21N5O4S
MOLECULAR WEIGHT: 439.48754
SMILES: COC(=O)C1=CC=CN2C1=NC(=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N
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Product OPENEYE NAME: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate
CAS Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoic acid (5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl ester
IUPAC NAME: (5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate
SYSTEMATIC NAME: (5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate
MOLECULAR FORMULA: C19H17F3N2O5S2
MOLECULAR WEIGHT: 474.47389
SMILES: CC1=C(N=C(O1)C2=CC=CS2)COC(=O)CCNS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F
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