Saturday, April 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 3-methylsulfanyl-6,7,8,9-tetrahydro-5H-pyridazino[3,4-b]azepine
CAS Name: 3-(methylthio)-6,7,8,9-tetrahydro-5H-pyridazino[3,4-b]azepine
IUPAC NAME: 3-methylsulfanyl-6,7,8,9-tetrahydro-5H-pyridazino[3,4-b]azepine
SYSTEMATIC NAME: 3-methylsulfanyl-6,7,8,9-tetrahydro-5H-pyridazino[3,4-b]azepine
MOLECULAR FORMULA: C9H13N3S
MOLECULAR WEIGHT: 195.28462
SMILES: CSC1=NN=C2C(=C1)CCCCN2
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Product OPENEYE NAME: 5-methyl-2-phenyl-hex-4-enenitrile
CAS Name: 5-methyl-2-phenyl-4-hexenenitrile
IUPAC NAME: 5-methyl-2-phenylhex-4-enenitrile
SYSTEMATIC NAME: 5-methyl-2-phenyl-hex-4-enenitrile
MOLECULAR FORMULA: C13H15N
MOLECULAR WEIGHT: 185.2649
SMILES: CC(=CCC(C#N)C1=CC=CC=C1)C
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Product OPENEYE NAME: methyl (3S,4S,5E)-5-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3,4-dimethyl-pentanoate
CAS Name: (3S,4S,5E)-5-[[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]imino]-3,4-dimethylpentanoic acid methyl ester
IUPAC NAME: methyl (3S,4S,5E)-5-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3,4-dimethylpentanoate
SYSTEMATIC NAME: methyl (3S,4S,5E)-5-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3,4-dimethyl-pentanoate
MOLECULAR FORMULA: C14H26N2O3
MOLECULAR WEIGHT: 270.36784
SMILES: C[C@@H](CC(=O)OC)[C@H](C)/C=N/N1CCC[C@@H]1COC
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Product OPENEYE NAME: methyl 3,4-dimethyl-5-oxo-5-phenyl-pentanoate
CAS Name: 3,4-dimethyl-5-oxo-5-phenylpentanoic acid methyl ester
IUPAC NAME: methyl 3,4-dimethyl-5-oxo-5-phenylpentanoate
SYSTEMATIC NAME: methyl 3,4-dimethyl-5-oxidanylidene-5-phenyl-pentanoate
MOLECULAR FORMULA: C14H18O3
MOLECULAR WEIGHT: 234.29092
SMILES: CC(CC(=O)OC)C(C)C(=O)C1=CC=CC=C1
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Product OPENEYE NAME: methyl (3R,4R)-3,4-dimethyl-5-oxo-5-phenyl-pentanoate
CAS Name: (3R,4R)-3,4-dimethyl-5-oxo-5-phenylpentanoic acid methyl ester
IUPAC NAME: methyl (3R,4R)-3,4-dimethyl-5-oxo-5-phenylpentanoate
SYSTEMATIC NAME: methyl (3R,4R)-3,4-dimethyl-5-oxidanylidene-5-phenyl-pentanoate
MOLECULAR FORMULA: C14H18O3
MOLECULAR WEIGHT: 234.29092
SMILES: C[C@H](CC(=O)OC)[C@@H](C)C(=O)C1=CC=CC=C1
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Product OPENEYE NAME: 7-bromo-N,N-diethyl-triazolo[1,5-a]pyridine-3-carboxamide
CAS Name: 7-bromo-N,N-diethyl-3-triazolo[1,5-a]pyridinecarboxamide
IUPAC NAME: 7-bromo-N,N-diethyltriazolo[1,5-a]pyridine-3-carboxamide
SYSTEMATIC NAME: 7-bromanyl-N,N-diethyl-[1,2,3]triazolo[1,5-a]pyridine-3-carboxamide
MOLECULAR FORMULA: C11H13BrN4O
MOLECULAR WEIGHT: 297.15112
SMILES: CCN(CC)C(=O)C1=C2C=CC=C(N2N=N1)Br
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Product OPENEYE NAME: 7-(4-methoxyphenoxy)-3-methyl-triazolo[1,5-a]pyridine
CAS Name: 7-(4-methoxyphenoxy)-3-methyltriazolo[1,5-a]pyridine
IUPAC NAME: 7-(4-methoxyphenoxy)-3-methyltriazolo[1,5-a]pyridine
SYSTEMATIC NAME: 7-(4-methoxyphenoxy)-3-methyl-[1,2,3]triazolo[1,5-a]pyridine
MOLECULAR FORMULA: C14H13N3O2
MOLECULAR WEIGHT: 255.27192
SMILES: CC1=C2C=CC=C(N2N=N1)OC3=CC=C(C=C3)OC
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Product OPENEYE NAME: 1-(6-methoxy-2-pyridyl)ethanone
CAS Name: 1-(6-methoxy-2-pyridinyl)ethanone
IUPAC NAME: 1-(6-methoxypyridin-2-yl)ethanone
SYSTEMATIC NAME: 1-(6-methoxypyridin-2-yl)ethanone
MOLECULAR FORMULA: C8H9NO2
MOLECULAR WEIGHT: 151.16256
SMILES: CC(=O)C1=NC(=CC=C1)OC
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Product OPENEYE NAME: N-methoxy-N-methyl-heptanamide
CAS Name: N-methoxy-N-methylheptanamide
IUPAC NAME: N-methoxy-N-methylheptanamide
SYSTEMATIC NAME: N-methoxy-N-methyl-heptanamide
MOLECULAR FORMULA: C9H19NO2
MOLECULAR WEIGHT: 173.25266
SMILES: CCCCCCC(=O)N(C)OC
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Product OPENEYE NAME: 1-(1,3-dithian-2-yl)-2,2,2-trifluoro-ethanone
CAS Name: 1-(1,3-dithian-2-yl)-2,2,2-trifluoroethanone
IUPAC NAME: 1-(1,3-dithian-2-yl)-2,2,2-trifluoroethanone
SYSTEMATIC NAME: 1-(1,3-dithian-2-yl)-2,2,2-tris(fluoranyl)ethanone
MOLECULAR FORMULA: C6H7F3OS2
MOLECULAR WEIGHT: 216.24439
SMILES: C1CSC(SC1)C(=O)C(F)(F)F
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