Tuesday, January 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 3-(3,5-dimethylisoxazol-4-yl)-1-(2,6-dimethylmorpholin-4-yl)propan-1-one
CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-1-(2,6-dimethyl-4-morpholinyl)-1-propanone
IUPAC NAME: 1-(2,6-dimethylmorpholin-4-yl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propan-1-one
SYSTEMATIC NAME: 1-(2,6-dimethylmorpholin-4-yl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propan-1-one
MOLECULAR FORMULA: C14H22N2O3
MOLECULAR WEIGHT: 266.33608
SMILES: CC1CN(CC(O1)C)C(=O)CCC2=C(ON=C2C)C
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Product OPENEYE NAME: (2,6-dimethylmorpholin-4-yl)-(2-phenyltriazol-4-yl)methanone
CAS Name: (2,6-dimethyl-4-morpholinyl)-(2-phenyl-4-triazolyl)methanone
IUPAC NAME: (2,6-dimethylmorpholin-4-yl)-(2-phenyltriazol-4-yl)methanone
SYSTEMATIC NAME: (2,6-dimethylmorpholin-4-yl)-(2-phenyl-1,2,3-triazol-4-yl)methanone
MOLECULAR FORMULA: C15H18N4O2
MOLECULAR WEIGHT: 286.32902
SMILES: CC1CN(CC(O1)C)C(=O)C2=NN(N=C2)C3=CC=CC=C3
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Product OPENEYE NAME: 2-benzyloxy-1-pyrrolidin-1-yl-ethanone
CAS Name: 2-phenylmethoxy-1-(1-pyrrolidinyl)ethanone
IUPAC NAME: 2-phenylmethoxy-1-pyrrolidin-1-ylethanone
SYSTEMATIC NAME: 2-phenylmethoxy-1-pyrrolidin-1-yl-ethanone
MOLECULAR FORMULA: C13H17NO2
MOLECULAR WEIGHT: 219.27958
SMILES: C1CCN(C1)C(=O)COCC2=CC=CC=C2
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Product OPENEYE NAME: 3-(3,5-dimethylisoxazol-4-yl)-1-pyrrolidin-1-yl-propan-1-one
CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-1-(1-pyrrolidinyl)-1-propanone
IUPAC NAME: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-pyrrolidin-1-ylpropan-1-one
SYSTEMATIC NAME: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-pyrrolidin-1-yl-propan-1-one
MOLECULAR FORMULA: C12H18N2O2
MOLECULAR WEIGHT: 222.28352
SMILES: CC1=C(C(=NO1)C)CCC(=O)N2CCCC2
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Product OPENEYE NAME: N-(tetrahydrofuran-2-ylmethyl)-3-(2-thienyl)propanamide
CAS Name: N-(2-oxolanylmethyl)-3-thiophen-2-ylpropanamide
IUPAC NAME: N-(oxolan-2-ylmethyl)-3-thiophen-2-ylpropanamide
SYSTEMATIC NAME: N-(oxolan-2-ylmethyl)-3-thiophen-2-yl-propanamide
MOLECULAR FORMULA: C12H17NO2S
MOLECULAR WEIGHT: 239.33388
SMILES: C1CC(OC1)CNC(=O)CCC2=CC=CS2
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Product OPENEYE NAME: 3-methyl-4-oxo-N-(tetrahydrofuran-2-ylmethyl)-1,5,6,7-tetrahydroindole-2-carboxamide
CAS Name: 3-methyl-4-oxo-N-(2-oxolanylmethyl)-1,5,6,7-tetrahydroindole-2-carboxamide
IUPAC NAME: 3-methyl-4-oxo-N-(oxolan-2-ylmethyl)-1,5,6,7-tetrahydroindole-2-carboxamide
SYSTEMATIC NAME: 3-methyl-4-oxidanylidene-N-(oxolan-2-ylmethyl)-1,5,6,7-tetrahydroindole-2-carboxamide
MOLECULAR FORMULA: C15H20N2O3
MOLECULAR WEIGHT: 276.3309
SMILES: CC1=C(NC2=C1C(=O)CCC2)C(=O)NCC3CCCO3
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Product OPENEYE NAME: 2-(2-oxo-1-pyridyl)-N-(tetrahydrofuran-2-ylmethyl)acetamide
CAS Name: N-(2-oxolanylmethyl)-2-(2-oxo-1-pyridinyl)acetamide
IUPAC NAME: N-(oxolan-2-ylmethyl)-2-(2-oxopyridin-1-yl)acetamide
SYSTEMATIC NAME: 2-(2-oxidanylidenepyridin-1-yl)-N-(oxolan-2-ylmethyl)ethanamide
MOLECULAR FORMULA: C12H16N2O3
MOLECULAR WEIGHT: 236.26704
SMILES: C1CC(OC1)CNC(=O)CN2C=CC=CC2=O
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Product OPENEYE NAME: 3-(3,5-dimethylisoxazol-4-yl)-N-(tetrahydrofuran-2-ylmethyl)propanamide
CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-N-(2-oxolanylmethyl)propanamide
IUPAC NAME: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(oxolan-2-ylmethyl)propanamide
SYSTEMATIC NAME: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(oxolan-2-ylmethyl)propanamide
MOLECULAR FORMULA: C13H20N2O3
MOLECULAR WEIGHT: 252.3095
SMILES: CC1=C(C(=NO1)C)CCC(=O)NCC2CCCO2
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Product OPENEYE NAME: 3-methyl-2-(4-phenylpiperazine-1-carbonyl)-1,5,6,7-tetrahydroindol-4-one
CAS Name: 3-methyl-2-[oxo-(4-phenyl-1-piperazinyl)methyl]-1,5,6,7-tetrahydroindol-4-one
IUPAC NAME: 3-methyl-2-(4-phenylpiperazine-1-carbonyl)-1,5,6,7-tetrahydroindol-4-one
SYSTEMATIC NAME: 3-methyl-2-(4-phenylpiperazin-1-yl)carbonyl-1,5,6,7-tetrahydroindol-4-one
MOLECULAR FORMULA: C20H23N3O2
MOLECULAR WEIGHT: 337.41552
SMILES: CC1=C(NC2=C1C(=O)CCC2)C(=O)N3CCN(CC3)C4=CC=CC=C4
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Product OPENEYE NAME: N-(2-furylmethyl)-N-methyl-2-phenoxy-pyridine-3-carboxamide
CAS Name: N-(2-furanylmethyl)-N-methyl-2-phenoxy-3-pyridinecarboxamide
IUPAC NAME: N-(furan-2-ylmethyl)-N-methyl-2-phenoxypyridine-3-carboxamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-N-methyl-2-phenoxy-pyridine-3-carboxamide
MOLECULAR FORMULA: C18H16N2O3
MOLECULAR WEIGHT: 308.33124
SMILES: CN(CC1=CC=CO1)C(=O)C2=C(N=CC=C2)OC3=CC=CC=C3
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Product OPENEYE NAME: N-(2-furylmethyl)-N-methyl-1-oxo-isochromane-3-carboxamide
CAS Name: N-(2-furanylmethyl)-N-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
IUPAC NAME: N-(furan-2-ylmethyl)-N-methyl-1-oxo-3,4-dihydroisochromene-3-carboxamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-N-methyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide
MOLECULAR FORMULA: C16H15NO4
MOLECULAR WEIGHT: 285.2946
SMILES: CN(CC1=CC=CO1)C(=O)C2CC3=CC=CC=C3C(=O)O2
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Product OPENEYE NAME: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-2-(2-oxo-1-pyridyl)acetamide
CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide
IUPAC NAME: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-2-(2-oxopyridin-1-yl)acetamide
SYSTEMATIC NAME: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-2-(2-oxidanylidenepyridin-1-yl)ethanamide
MOLECULAR FORMULA: C17H18N2O4
MOLECULAR WEIGHT: 314.33582
SMILES: CN(CC1=CC2=C(C=C1)OCCO2)C(=O)CN3C=CC=CC3=O
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Product OPENEYE NAME: N-[2-(dimethylamino)-2-methyl-propyl]-4-(methoxymethyl)benzamide
CAS Name: N-[2-(dimethylamino)-2-methylpropyl]-4-(methoxymethyl)benzamide
IUPAC NAME: N-[2-(dimethylamino)-2-methylpropyl]-4-(methoxymethyl)benzamide
SYSTEMATIC NAME: N-[2-(dimethylamino)-2-methyl-propyl]-4-(methoxymethyl)benzamide
MOLECULAR FORMULA: C15H24N2O2
MOLECULAR WEIGHT: 264.36326
SMILES: CC(C)(CNC(=O)C1=CC=C(C=C1)COC)N(C)C
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Product OPENEYE NAME: N-methoxy-N,3-dimethyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxamide
CAS Name: N-methoxy-N,3-dimethyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxamide
IUPAC NAME: N-methoxy-N,3-dimethyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxamide
SYSTEMATIC NAME: N-methoxy-N,3-dimethyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxamide
MOLECULAR FORMULA: C12H16N2O3
MOLECULAR WEIGHT: 236.26704
SMILES: CC1=C(NC2=C1C(=O)CCC2)C(=O)N(C)OC
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Product OPENEYE NAME: N-[4-(diethylamino)phenyl]-2-(2-oxo-1-pyridyl)acetamide
CAS Name: N-[4-(diethylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide
IUPAC NAME: N-[4-(diethylamino)phenyl]-2-(2-oxopyridin-1-yl)acetamide
SYSTEMATIC NAME: N-[4-(diethylamino)phenyl]-2-(2-oxidanylidenepyridin-1-yl)ethanamide
MOLECULAR FORMULA: C17H21N3O2
MOLECULAR WEIGHT: 299.36754
SMILES: CCN(CC)C1=CC=C(C=C1)NC(=O)CN2C=CC=CC2=O
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Product OPENEYE NAME: 3-methyl-4-oxo-N-thiazol-2-yl-1,5,6,7-tetrahydroindole-2-carboxamide
CAS Name: 3-methyl-4-oxo-N-(2-thiazolyl)-1,5,6,7-tetrahydroindole-2-carboxamide
IUPAC NAME: 3-methyl-4-oxo-N-(1,3-thiazol-2-yl)-1,5,6,7-tetrahydroindole-2-carboxamide
SYSTEMATIC NAME: 3-methyl-4-oxidanylidene-N-(1,3-thiazol-2-yl)-1,5,6,7-tetrahydroindole-2-carboxamide
MOLECULAR FORMULA: C13H13N3O2S
MOLECULAR WEIGHT: 275.32622
SMILES: CC1=C(NC2=C1C(=O)CCC2)C(=O)NC3=NC=CS3
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Product OPENEYE NAME: 3-(3-methylpiperidine-1-carbonyl)isochroman-1-one
CAS Name: 3-[(3-methyl-1-piperidinyl)-oxomethyl]-3,4-dihydro-1H-2-benzopyran-1-one
IUPAC NAME: 3-(3-methylpiperidine-1-carbonyl)-3,4-dihydroisochromen-1-one
SYSTEMATIC NAME: 3-(3-methylpiperidin-1-yl)carbonyl-3,4-dihydroisochromen-1-one
MOLECULAR FORMULA: C16H19NO3
MOLECULAR WEIGHT: 273.32696
SMILES: CC1CCCN(C1)C(=O)C2CC3=CC=CC=C3C(=O)O2
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Product OPENEYE NAME: (3,4-dipropoxyphenyl)-morpholino-methanone
CAS Name: (3,4-dipropoxyphenyl)-(4-morpholinyl)methanone
IUPAC NAME: (3,4-dipropoxyphenyl)-morpholin-4-ylmethanone
SYSTEMATIC NAME: (3,4-dipropoxyphenyl)-morpholin-4-yl-methanone
MOLECULAR FORMULA: C17H25NO4
MOLECULAR WEIGHT: 307.3847
SMILES: CCCOC1=C(C=C(C=C1)C(=O)N2CCOCC2)OCCC
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Product OPENEYE NAME: 1-morpholino-2-tetralin-6-yl-ethanone
CAS Name: 1-(4-morpholinyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
IUPAC NAME: 1-morpholin-4-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
SYSTEMATIC NAME: 1-morpholin-4-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
MOLECULAR FORMULA: C16H21NO2
MOLECULAR WEIGHT: 259.34344
SMILES: C1CCC2=C(C1)C=CC(=C2)CC(=O)N3CCOCC3
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Product OPENEYE NAME: 3-(3,5-dimethylisoxazol-4-yl)-1-morpholino-propan-1-one
CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-1-(4-morpholinyl)-1-propanone
IUPAC NAME: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-morpholin-4-ylpropan-1-one
SYSTEMATIC NAME: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-morpholin-4-yl-propan-1-one
MOLECULAR FORMULA: C12H18N2O3
MOLECULAR WEIGHT: 238.28292
SMILES: CC1=C(C(=NO1)C)CCC(=O)N2CCOCC2
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Product OPENEYE NAME: (2-methoxyphenyl) 2-(5-acetyl-2-methoxy-phenyl)acetate
CAS Name: 2-(5-acetyl-2-methoxyphenyl)acetic acid (2-methoxyphenyl) ester
IUPAC NAME: (2-methoxyphenyl) 2-(5-acetyl-2-methoxyphenyl)acetate
SYSTEMATIC NAME: (2-methoxyphenyl) 2-(5-ethanoyl-2-methoxy-phenyl)ethanoate
MOLECULAR FORMULA: C18H18O5
MOLECULAR WEIGHT: 314.33252
SMILES: CC(=O)C1=CC(=C(C=C1)OC)CC(=O)OC2=CC=CC=C2OC
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Product OPENEYE NAME: N,N-diethyl-2-(2-thienylmethylsulfanyl)acetamide
CAS Name: N,N-diethyl-2-(thiophen-2-ylmethylthio)acetamide
IUPAC NAME: N,N-diethyl-2-(thiophen-2-ylmethylsulfanyl)acetamide
SYSTEMATIC NAME: N,N-diethyl-2-(thiophen-2-ylmethylsulfanyl)ethanamide
MOLECULAR FORMULA: C11H17NOS2
MOLECULAR WEIGHT: 243.38878
SMILES: CCN(CC)C(=O)CSCC1=CC=CS1
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Product OPENEYE NAME: 1-(4-acetylpiperazin-1-yl)-2-[(5-chloro-2-thienyl)methylsulfanyl]ethanone
CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[(5-chloro-2-thiophenyl)methylthio]ethanone
IUPAC NAME: 1-(4-acetylpiperazin-1-yl)-2-[(5-chlorothiophen-2-yl)methylsulfanyl]ethanone
SYSTEMATIC NAME: 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-1-(4-ethanoylpiperazin-1-yl)ethanone
MOLECULAR FORMULA: C13H17ClN2O2S2
MOLECULAR WEIGHT: 332.86928
SMILES: CC(=O)N1CCN(CC1)C(=O)CSCC2=CC=C(S2)Cl
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