Monday, May 13, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (2R)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)sulfanyl-propanamide
CAS Name: (2R)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(4-nitrophenyl)thio]propanamide
IUPAC NAME: (2R)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)sulfanylpropanamide
SYSTEMATIC NAME: (2R)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)sulfanyl-propanamide
MOLECULAR FORMULA: C18H16N2O6S
MOLECULAR WEIGHT: 388.39444
SMILES: C[C@H](C(=O)NC1=CC2=C(C=C1C(=O)C)OCO2)SC3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)sulfanyl-propanamide
CAS Name: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(4-nitrophenyl)thio]propanamide
IUPAC NAME: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)sulfanylpropanamide
SYSTEMATIC NAME: (2S)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)sulfanyl-propanamide
MOLECULAR FORMULA: C18H16N2O6S
MOLECULAR WEIGHT: 388.39444
SMILES: C[C@@H](C(=O)NC1=CC2=C(C=C1C(=O)C)OCO2)SC3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-2,5-dimethoxy-benzamide
CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2,5-dimethoxybenzamide
IUPAC NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-2,5-dimethoxybenzamide
SYSTEMATIC NAME: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2,5-dimethoxy-benzamide
MOLECULAR FORMULA: C18H17NO6
MOLECULAR WEIGHT: 343.33068
SMILES: CC(=O)C1=CC2=C(C=C1NC(=O)C3=C(C=CC(=C3)OC)OC)OCO2
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Product OPENEYE NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(5-chloro-2-thienyl)methylsulfanyl]acetamide
CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(5-chloro-2-thiophenyl)methylthio]acetamide
IUPAC NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetamide
SYSTEMATIC NAME: 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide
MOLECULAR FORMULA: C16H14ClNO4S2
MOLECULAR WEIGHT: 383.86966
SMILES: CC(=O)C1=CC2=C(C=C1NC(=O)CSCC3=CC=C(S3)Cl)OCO2
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Product OPENEYE NAME: N-[3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-3-oxo-propyl]adamantane-1-carboxamide
CAS Name: N-[3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-3-oxopropyl]-1-adamantanecarboxamide
IUPAC NAME: N-[3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-3-oxopropyl]adamantane-1-carboxamide
SYSTEMATIC NAME: N-[3-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide
MOLECULAR FORMULA: C23H28N2O5
MOLECULAR WEIGHT: 412.47882
SMILES: CC(=O)C1=CC2=C(C=C1NC(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4)OCO2
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Product OPENEYE NAME: (3S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-1-cyclopentyl-5-oxo-pyrrolidine-3-carboxamide
CAS Name: (3S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-1-cyclopentyl-5-oxo-3-pyrrolidinecarboxamide
IUPAC NAME: (3S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
SYSTEMATIC NAME: (3S)-1-cyclopentyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C19H22N2O5
MOLECULAR WEIGHT: 358.38838
SMILES: CC(=O)C1=CC2=C(C=C1NC(=O)[C@H]3CC(=O)N(C3)C4CCCC4)OCO2
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Product OPENEYE NAME: (3R)-N-(6-acetyl-1,3-benzodioxol-5-yl)-1-cyclopentyl-5-oxo-pyrrolidine-3-carboxamide
CAS Name: (3R)-N-(6-acetyl-1,3-benzodioxol-5-yl)-1-cyclopentyl-5-oxo-3-pyrrolidinecarboxamide
IUPAC NAME: (3R)-N-(6-acetyl-1,3-benzodioxol-5-yl)-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
SYSTEMATIC NAME: (3R)-1-cyclopentyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C19H22N2O5
MOLECULAR WEIGHT: 358.38838
SMILES: CC(=O)C1=CC2=C(C=C1NC(=O)[C@@H]3CC(=O)N(C3)C4CCCC4)OCO2
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Product OPENEYE NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-tetralin-6-yl-acetamide
CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
IUPAC NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
SYSTEMATIC NAME: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamide
MOLECULAR FORMULA: C21H21NO4
MOLECULAR WEIGHT: 351.39574
SMILES: CC(=O)C1=CC2=C(C=C1NC(=O)CC3=CC4=C(CCCC4)C=C3)OCO2
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Product OPENEYE NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide
CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-6-phenyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide
IUPAC NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-6-phenyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
SYSTEMATIC NAME: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide
MOLECULAR FORMULA: C25H22N4O4
MOLECULAR WEIGHT: 442.46658
SMILES: CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4C(=O)C)OCO5
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Product OPENEYE NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxamide
CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2,4-dimethylphenyl)-5-methyl-4-triazolecarboxamide
IUPAC NAME: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2,4-dimethylphenyl)-5-methyltriazole-4-carboxamide
SYSTEMATIC NAME: 2-(2,4-dimethylphenyl)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-methyl-1,2,3-triazole-4-carboxamide
MOLECULAR FORMULA: C21H20N4O4
MOLECULAR WEIGHT: 392.4079
SMILES: CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=CC4=C(C=C3C(=O)C)OCO4)C)C
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