Thursday, May 30, 2013

All Chemical Compounds Information



Product OPENEYE NAME: (E)-N-tert-butyl-3-[5-[(1S,2S)-2-methylcyclopropyl]-2-furyl]prop-2-enamide
CAS Name: (E)-N-tert-butyl-3-[5-[(1S,2S)-2-methylcyclopropyl]-2-furanyl]-2-propenamide
IUPAC NAME: (E)-N-tert-butyl-3-[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]prop-2-enamide
SYSTEMATIC NAME: (E)-N-tert-butyl-3-[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]prop-2-enamide
MOLECULAR FORMULA: C15H21NO2
MOLECULAR WEIGHT: 247.33274
SMILES: C[C@H]1C[C@@H]1C2=CC=C(O2)/C=C/C(=O)NC(C)(C)C
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Product OPENEYE NAME: (E)-N-tert-butyl-3-[5-[(1R,2R)-2-methylcyclopropyl]-2-furyl]prop-2-enamide
CAS Name: (E)-N-tert-butyl-3-[5-[(1R,2R)-2-methylcyclopropyl]-2-furanyl]-2-propenamide
IUPAC NAME: (E)-N-tert-butyl-3-[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]prop-2-enamide
SYSTEMATIC NAME: (E)-N-tert-butyl-3-[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]prop-2-enamide
MOLECULAR FORMULA: C15H21NO2
MOLECULAR WEIGHT: 247.33274
SMILES: C[C@@H]1C[C@H]1C2=CC=C(O2)/C=C/C(=O)NC(C)(C)C
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Product OPENEYE NAME: (E)-N-tert-butyl-3-[5-[(1R,2S)-2-methylcyclopropyl]-2-furyl]prop-2-enamide
CAS Name: (E)-N-tert-butyl-3-[5-[(1R,2S)-2-methylcyclopropyl]-2-furanyl]-2-propenamide
IUPAC NAME: (E)-N-tert-butyl-3-[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]prop-2-enamide
SYSTEMATIC NAME: (E)-N-tert-butyl-3-[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]prop-2-enamide
MOLECULAR FORMULA: C15H21NO2
MOLECULAR WEIGHT: 247.33274
SMILES: C[C@H]1C[C@H]1C2=CC=C(O2)/C=C/C(=O)NC(C)(C)C
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Product OPENEYE NAME: 3-(benzylcarbamoylamino)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-propanamide
CAS Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-3-[[oxo-[(phenylmethyl)amino]methyl]amino]propanamide
IUPAC NAME: 3-(benzylcarbamoylamino)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methylpropanamide
SYSTEMATIC NAME: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-3-[(phenylmethyl)carbamoylamino]propanamide
MOLECULAR FORMULA: C21H25N3O4
MOLECULAR WEIGHT: 383.4409
SMILES: CN(C[C@@H]1COC2=CC=CC=C2O1)C(=O)CCNC(=O)NCC3=CC=CC=C3
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Product OPENEYE NAME: 3-(benzylcarbamoylamino)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-propanamide
CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-3-[[oxo-[(phenylmethyl)amino]methyl]amino]propanamide
IUPAC NAME: 3-(benzylcarbamoylamino)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methylpropanamide
SYSTEMATIC NAME: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-3-[(phenylmethyl)carbamoylamino]propanamide
MOLECULAR FORMULA: C21H25N3O4
MOLECULAR WEIGHT: 383.4409
SMILES: CN(C[C@H]1COC2=CC=CC=C2O1)C(=O)CCNC(=O)NCC3=CC=CC=C3
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Product OPENEYE NAME: 5-(4-chlorophenyl)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-isoxazole-3-carboxamide
CAS Name: 5-(4-chlorophenyl)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-3-isoxazolecarboxamide
IUPAC NAME: 5-(4-chlorophenyl)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-(4-chlorophenyl)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C20H17ClN2O4
MOLECULAR WEIGHT: 384.81298
SMILES: CN(C[C@@H]1COC2=CC=CC=C2O1)C(=O)C3=NOC(=C3)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 5-(4-chlorophenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-isoxazole-3-carboxamide
CAS Name: 5-(4-chlorophenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-3-isoxazolecarboxamide
IUPAC NAME: 5-(4-chlorophenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-(4-chlorophenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C20H17ClN2O4
MOLECULAR WEIGHT: 384.81298
SMILES: CN(C[C@H]1COC2=CC=CC=C2O1)C(=O)C3=NOC(=C3)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 2,4-dimethyl-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]thiazole-5-carboxamide
CAS Name: 2,4-dimethyl-N-[(2S)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-5-thiazolecarboxamide
IUPAC NAME: 2,4-dimethyl-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]-1,3-thiazole-5-carboxamide
SYSTEMATIC NAME: 2,4-dimethyl-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-1,3-thiazole-5-carboxamide
MOLECULAR FORMULA: C18H26N3OS2+
MOLECULAR WEIGHT: 364.54854
SMILES: CC1CC[NH+](CC1)[C@@H](CNC(=O)C2=C(N=C(S2)C)C)C3=CC=CS3
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Product OPENEYE NAME: 2,4-dimethyl-N-[(2S)-2-(4-methyl-1-piperidyl)-2-(2-thienyl)ethyl]thiazole-5-carboxamide
CAS Name: 2,4-dimethyl-N-[(2S)-2-(4-methyl-1-piperidinyl)-2-thiophen-2-ylethyl]-5-thiazolecarboxamide
IUPAC NAME: 2,4-dimethyl-N-[(2S)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]-1,3-thiazole-5-carboxamide
SYSTEMATIC NAME: 2,4-dimethyl-N-[(2S)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-1,3-thiazole-5-carboxamide
MOLECULAR FORMULA: C18H25N3OS2
MOLECULAR WEIGHT: 363.5406
SMILES: CC1CCN(CC1)[C@@H](CNC(=O)C2=C(N=C(S2)C)C)C3=CC=CS3
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Product OPENEYE NAME: 2,4-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]thiazole-5-carboxamide
CAS Name: 2,4-dimethyl-N-[(2R)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-5-thiazolecarboxamide
IUPAC NAME: 2,4-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]-1,3-thiazole-5-carboxamide
SYSTEMATIC NAME: 2,4-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-1,3-thiazole-5-carboxamide
MOLECULAR FORMULA: C18H26N3OS2+
MOLECULAR WEIGHT: 364.54854
SMILES: CC1CC[NH+](CC1)[C@H](CNC(=O)C2=C(N=C(S2)C)C)C3=CC=CS3
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Product OPENEYE NAME: 2,4-dimethyl-N-[(2R)-2-(4-methyl-1-piperidyl)-2-(2-thienyl)ethyl]thiazole-5-carboxamide
CAS Name: 2,4-dimethyl-N-[(2R)-2-(4-methyl-1-piperidinyl)-2-thiophen-2-ylethyl]-5-thiazolecarboxamide
IUPAC NAME: 2,4-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]-1,3-thiazole-5-carboxamide
SYSTEMATIC NAME: 2,4-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-1,3-thiazole-5-carboxamide
MOLECULAR FORMULA: C18H25N3OS2
MOLECULAR WEIGHT: 363.5406
SMILES: CC1CCN(CC1)[C@H](CNC(=O)C2=C(N=C(S2)C)C)C3=CC=CS3
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