Friday, May 31, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (2S)-N-methoxy-2-(4-methylphenoxy)propanamide
CAS Name: (2S)-N-methoxy-2-(4-methylphenoxy)propanamide
IUPAC NAME: (2S)-N-methoxy-2-(4-methylphenoxy)propanamide
SYSTEMATIC NAME: (2S)-N-methoxy-2-(4-methylphenoxy)propanamide
MOLECULAR FORMULA: C11H15NO3
MOLECULAR WEIGHT: 209.2417
SMILES: CC1=CC=C(C=C1)O[C@@H](C)C(=O)NOC
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Product OPENEYE NAME: N-[[4-(2-methylthiazol-4-yl)phenyl]methyl]-2-[5-(p-tolyl)tetrazol-2-yl]acetamide
CAS Name: 2-[5-(4-methylphenyl)-2-tetrazolyl]-N-[[4-(2-methyl-4-thiazolyl)phenyl]methyl]acetamide
IUPAC NAME: 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]acetamide
SYSTEMATIC NAME: 2-[5-(4-methylphenyl)-1,2,3,4-tetrazol-2-yl]-N-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]ethanamide
MOLECULAR FORMULA: C21H20N6OS
MOLECULAR WEIGHT: 404.4881
SMILES: CC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)NCC3=CC=C(C=C3)C4=CSC(=N4)C
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Product OPENEYE NAME: (2R)-2-methyl-1-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
CAS Name: (2R)-2-methyl-1-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-1-butanone
IUPAC NAME: (2R)-2-methyl-1-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
SYSTEMATIC NAME: (2R)-2-methyl-1-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
MOLECULAR FORMULA: C15H21NOS
MOLECULAR WEIGHT: 263.39834
SMILES: CC[C@@H](C)C(=O)N1CC[C@H](SC2=CC=CC=C21)C
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Product OPENEYE NAME: (2S)-2-methyl-1-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
CAS Name: (2S)-2-methyl-1-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-1-butanone
IUPAC NAME: (2S)-2-methyl-1-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
SYSTEMATIC NAME: (2S)-2-methyl-1-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
MOLECULAR FORMULA: C15H21NOS
MOLECULAR WEIGHT: 263.39834
SMILES: CC[C@H](C)C(=O)N1CC[C@H](SC2=CC=CC=C21)C
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Product OPENEYE NAME: (2R)-2-methyl-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
CAS Name: (2R)-2-methyl-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-1-butanone
IUPAC NAME: (2R)-2-methyl-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
SYSTEMATIC NAME: (2R)-2-methyl-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
MOLECULAR FORMULA: C15H21NOS
MOLECULAR WEIGHT: 263.39834
SMILES: CC[C@@H](C)C(=O)N1CC[C@@H](SC2=CC=CC=C21)C
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Product OPENEYE NAME: (2S)-2-methyl-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
CAS Name: (2S)-2-methyl-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-1-butanone
IUPAC NAME: (2S)-2-methyl-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
SYSTEMATIC NAME: (2S)-2-methyl-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]butan-1-one
MOLECULAR FORMULA: C15H21NOS
MOLECULAR WEIGHT: 263.39834
SMILES: CC[C@H](C)C(=O)N1CC[C@@H](SC2=CC=CC=C21)C
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Product OPENEYE NAME: (2R)-2-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[3-(1H-benzimidazol-2-yl)propyl]-4-methylsulfanyl-butanamide
CAS Name: (2R)-2-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[3-(1H-benzimidazol-2-yl)propyl]-4-(methylthio)butanamide
IUPAC NAME: (2R)-2-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[3-(1H-benzimidazol-2-yl)propyl]-4-methylsulfanylbutanamide
SYSTEMATIC NAME: (2R)-2-[(3aS,7aS)-1,3-bis(oxidanylidene)-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[3-(1H-benzimidazol-2-yl)propyl]-4-methylsulfanyl-butanamide
MOLECULAR FORMULA: C23H30N4O3S
MOLECULAR WEIGHT: 442.5743
SMILES: CSCC[C@H](C(=O)NCCCC1=NC2=CC=CC=C2N1)N3C(=O)[C@H]4CCCC[C@@H]4C3=O
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Product OPENEYE NAME: 2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]acetamide
CAS Name: 2-[[1-(3-methoxyphenyl)-2-imidazolyl]thio]-N-[2-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]acetamide
IUPAC NAME: 2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]acetamide
SYSTEMATIC NAME: 2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]ethanamide
MOLECULAR FORMULA: C24H24N4O2S2
MOLECULAR WEIGHT: 464.60296
SMILES: CC1=NC(=CS1)C2=CC=C(C=C2)CCNC(=O)CSC3=NC=CN3C4=CC(=CC=C4)OC
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Product OPENEYE NAME: 6-methyl-N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxamide
CAS Name: 6-methyl-N-[2-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxamide
IUPAC NAME: 6-methyl-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxamide
SYSTEMATIC NAME: 6-methyl-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-4-oxidanylidene-3H-furo[2,3-d]pyrimidine-5-carboxamide
MOLECULAR FORMULA: C20H18N4O3S
MOLECULAR WEIGHT: 394.44692
SMILES: CC1=C(C2=C(O1)N=CNC2=O)C(=O)NCCC3=CC=C(C=C3)C4=CSC(=N4)C
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Product OPENEYE NAME: [1-(furan-3-carbonyl)-4-piperidyl]-pyrrolidin-1-yl-methanone
CAS Name: [1-[3-furanyl(oxo)methyl]-4-piperidinyl]-(1-pyrrolidinyl)methanone
IUPAC NAME: [1-(furan-3-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
SYSTEMATIC NAME: [1-(furan-3-ylcarbonyl)piperidin-4-yl]-pyrrolidin-1-yl-methanone
MOLECULAR FORMULA: C15H20N2O3
MOLECULAR WEIGHT: 276.3309
SMILES: C1CCN(C1)C(=O)C2CCN(CC2)C(=O)C3=COC=C3
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Product OPENEYE NAME: N-methyl-1-(3-methylbutanoyl)piperidine-4-carboxamide
CAS Name: N-methyl-1-(3-methyl-1-oxobutyl)-4-piperidinecarboxamide
IUPAC NAME: N-methyl-1-(3-methylbutanoyl)piperidine-4-carboxamide
SYSTEMATIC NAME: N-methyl-1-(3-methylbutanoyl)piperidine-4-carboxamide
MOLECULAR FORMULA: C12H22N2O2
MOLECULAR WEIGHT: 226.31528
SMILES: CC(C)CC(=O)N1CCC(CC1)C(=O)NC
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Product OPENEYE NAME: 1-(cyclobutanecarbonyl)-N-methyl-piperidine-4-carboxamide
CAS Name: 1-[cyclobutyl(oxo)methyl]-N-methyl-4-piperidinecarboxamide
IUPAC NAME: 1-(cyclobutanecarbonyl)-N-methylpiperidine-4-carboxamide
SYSTEMATIC NAME: 1-cyclobutylcarbonyl-N-methyl-piperidine-4-carboxamide
MOLECULAR FORMULA: C12H20N2O2
MOLECULAR WEIGHT: 224.2994
SMILES: CNC(=O)C1CCN(CC1)C(=O)C2CCC2
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