Friday, May 17, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2,5-dimethoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
CAS Name: 2,5-dimethoxy-N-[4-(4-methyl-1-piperazinyl)phenyl]benzamide
IUPAC NAME: 2,5-dimethoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
SYSTEMATIC NAME: 2,5-dimethoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
MOLECULAR FORMULA: C20H25N3O3
MOLECULAR WEIGHT: 355.4308
SMILES: CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)OC)OC
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Product OPENEYE NAME: 2-[(5-chloro-2-thienyl)methylsulfanyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide
CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]acetamide
IUPAC NAME: 2-[(5-chlorothiophen-2-yl)methylsulfanyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide
SYSTEMATIC NAME: 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide
MOLECULAR FORMULA: C18H23ClN3OS2+
MOLECULAR WEIGHT: 396.97772
SMILES: C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSCC3=CC=C(S3)Cl
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Product OPENEYE NAME: 2-[(5-chloro-2-thienyl)methylsulfanyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]-N-[4-(4-methyl-1-piperazinyl)phenyl]acetamide
IUPAC NAME: 2-[(5-chlorothiophen-2-yl)methylsulfanyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
SYSTEMATIC NAME: 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]ethanamide
MOLECULAR FORMULA: C18H22ClN3OS2
MOLECULAR WEIGHT: 395.96978
SMILES: CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSCC3=CC=C(S3)Cl
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Product OPENEYE NAME: N-(3,4-dichlorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
CAS Name: N-(3,4-dichlorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
IUPAC NAME: N-(3,4-dichlorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
SYSTEMATIC NAME: N-(3,4-dichlorophenyl)-4-oxidanylidene-4-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)butanamide
MOLECULAR FORMULA: C18H15Cl2N3O3
MOLECULAR WEIGHT: 392.236
SMILES: C1C(=O)NC2=CC=CC=C2N1C(=O)CCC(=O)NC3=CC(=C(C=C3)Cl)Cl
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Product OPENEYE NAME: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[4-(4-methylpiperazin-1-yl)phenyl]butanamide
CAS Name: 4-[(4-fluorophenyl)sulfonyl-methylamino]-N-[4-(4-methyl-1-piperazinyl)phenyl]butanamide
IUPAC NAME: 4-[(4-fluorophenyl)sulfonyl-methylamino]-N-[4-(4-methylpiperazin-1-yl)phenyl]butanamide
SYSTEMATIC NAME: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[4-(4-methylpiperazin-1-yl)phenyl]butanamide
MOLECULAR FORMULA: C22H29FN4O3S
MOLECULAR WEIGHT: 448.554063
SMILES: CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 4-(methoxymethyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
CAS Name: 4-(methoxymethyl)-N-[4-(4-methyl-1-piperazinyl)phenyl]benzamide
IUPAC NAME: 4-(methoxymethyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
SYSTEMATIC NAME: 4-(methoxymethyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
MOLECULAR FORMULA: C20H25N3O2
MOLECULAR WEIGHT: 339.4314
SMILES: CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)COC
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Product OPENEYE NAME: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(3-chlorophenyl)benzamide
CAS Name: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(3-chlorophenyl)benzamide
IUPAC NAME: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(3-chlorophenyl)benzamide
SYSTEMATIC NAME: N-(3-chlorophenyl)-4-[[(4-ethanoylphenyl)sulfonylamino]methyl]benzamide
MOLECULAR FORMULA: C22H19ClN2O4S
MOLECULAR WEIGHT: 442.91526
SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)Cl
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Product OPENEYE NAME: N-(3-chlorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
CAS Name: N-(3-chlorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
IUPAC NAME: N-(3-chlorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
SYSTEMATIC NAME: N-(3-chlorophenyl)-4-oxidanylidene-4-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)butanamide
MOLECULAR FORMULA: C18H16ClN3O3
MOLECULAR WEIGHT: 357.79094
SMILES: C1C(=O)NC2=CC=CC=C2N1C(=O)CCC(=O)NC3=CC(=CC=C3)Cl
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Product OPENEYE NAME: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(4-chlorophenyl)benzamide
CAS Name: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(4-chlorophenyl)benzamide
IUPAC NAME: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(4-chlorophenyl)benzamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-4-[[(4-ethanoylphenyl)sulfonylamino]methyl]benzamide
MOLECULAR FORMULA: C22H19ClN2O4S
MOLECULAR WEIGHT: 442.91526
SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-(4-chlorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
CAS Name: N-(4-chlorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
IUPAC NAME: N-(4-chlorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-4-oxidanylidene-4-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)butanamide
MOLECULAR FORMULA: C18H16ClN3O3
MOLECULAR WEIGHT: 357.79094
SMILES: C1C(=O)NC2=CC=CC=C2N1C(=O)CCC(=O)NC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-iodophenyl)acetamide
CAS Name: N-(2-iodophenyl)-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide
IUPAC NAME: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-iodophenyl)acetamide
SYSTEMATIC NAME: N-(2-iodanylphenyl)-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C18H17IN4OS
MOLECULAR WEIGHT: 464.32325
SMILES: CC1=NN=C(N1CC2=CC=CC=C2)SCC(=O)NC3=CC=CC=C3I
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Product OPENEYE NAME: 4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
CAS Name: 4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
IUPAC NAME: 4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
SYSTEMATIC NAME: 4-oxidanylidene-4-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
MOLECULAR FORMULA: C19H16F3N3O3
MOLECULAR WEIGHT: 391.34385
SMILES: C1C(=O)NC2=CC=CC=C2N1C(=O)CCC(=O)NC3=CC=CC(=C3)C(F)(F)F
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Product OPENEYE NAME: 2,4-dichloro-N-cyclopropyl-5-[(3R)-3-methylpiperidine-1-carbonyl]benzenesulfonamide
CAS Name: 2,4-dichloro-N-cyclopropyl-5-[[(3R)-3-methyl-1-piperidinyl]-oxomethyl]benzenesulfonamide
IUPAC NAME: 2,4-dichloro-N-cyclopropyl-5-[(3R)-3-methylpiperidine-1-carbonyl]benzenesulfonamide
SYSTEMATIC NAME: 2,4-bis(chloranyl)-N-cyclopropyl-5-[(3R)-3-methylpiperidin-1-yl]carbonyl-benzenesulfonamide
MOLECULAR FORMULA: C16H20Cl2N2O3S
MOLECULAR WEIGHT: 391.3126
SMILES: C[C@@H]1CCCN(C1)C(=O)C2=CC(=C(C=C2Cl)Cl)S(=O)(=O)NC3CC3
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Product OPENEYE NAME: 2,4-dichloro-N-cyclopropyl-5-[(3S)-3-methylpiperidine-1-carbonyl]benzenesulfonamide
CAS Name: 2,4-dichloro-N-cyclopropyl-5-[[(3S)-3-methyl-1-piperidinyl]-oxomethyl]benzenesulfonamide
IUPAC NAME: 2,4-dichloro-N-cyclopropyl-5-[(3S)-3-methylpiperidine-1-carbonyl]benzenesulfonamide
SYSTEMATIC NAME: 2,4-bis(chloranyl)-N-cyclopropyl-5-[(3S)-3-methylpiperidin-1-yl]carbonyl-benzenesulfonamide
MOLECULAR FORMULA: C16H20Cl2N2O3S
MOLECULAR WEIGHT: 391.3126
SMILES: C[C@H]1CCCN(C1)C(=O)C2=CC(=C(C=C2Cl)Cl)S(=O)(=O)NC3CC3
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Product OPENEYE NAME: N-(3-morpholino-3-oxo-propyl)adamantane-1-carboxamide
CAS Name: N-[3-(4-morpholinyl)-3-oxopropyl]-1-adamantanecarboxamide
IUPAC NAME: N-(3-morpholin-4-yl-3-oxopropyl)adamantane-1-carboxamide
SYSTEMATIC NAME: N-(3-morpholin-4-yl-3-oxidanylidene-propyl)adamantane-1-carboxamide
MOLECULAR FORMULA: C18H28N2O3
MOLECULAR WEIGHT: 320.42652
SMILES: C1COCCN1C(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3
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Product OPENEYE NAME: 4-(4-acetylpiperazine-1-carbonyl)benzamide
CAS Name: 4-[(4-acetyl-1-piperazinyl)-oxomethyl]benzamide
IUPAC NAME: 4-(4-acetylpiperazine-1-carbonyl)benzamide
SYSTEMATIC NAME: 4-(4-ethanoylpiperazin-1-yl)carbonylbenzamide
MOLECULAR FORMULA: C14H17N3O3
MOLECULAR WEIGHT: 275.30308
SMILES: CC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)C(=O)N
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Product OPENEYE NAME: N-(4-tert-butylphenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
CAS Name: N-(4-tert-butylphenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
IUPAC NAME: N-(4-tert-butylphenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
SYSTEMATIC NAME: N-(4-tert-butylphenyl)-4-oxidanylidene-4-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)butanamide
MOLECULAR FORMULA: C22H25N3O3
MOLECULAR WEIGHT: 379.4522
SMILES: CC(C)(C)C1=CC=C(C=C1)NC(=O)CCC(=O)N2CC(=O)NC3=CC=CC=C32
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Product OPENEYE NAME: 2-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CAS Name: 2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]acetamide
IUPAC NAME: 2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
SYSTEMATIC NAME: 2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]ethanamide
MOLECULAR FORMULA: C19H25N5O2S
MOLECULAR WEIGHT: 387.4991
SMILES: CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NCCCN3CCCC3=O)C
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Product OPENEYE NAME: 4-cyclohexyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
CAS Name: 4-cyclohexyl-N-[3-(2-oxo-1-pyrrolidinyl)propyl]benzamide
IUPAC NAME: 4-cyclohexyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
SYSTEMATIC NAME: 4-cyclohexyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]benzamide
MOLECULAR FORMULA: C20H28N2O2
MOLECULAR WEIGHT: 328.44852
SMILES: C1CCC(CC1)C2=CC=C(C=C2)C(=O)NCCCN3CCCC3=O
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Product OPENEYE NAME: N-(2-fluorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
CAS Name: N-(2-fluorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
IUPAC NAME: N-(2-fluorophenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
SYSTEMATIC NAME: N-(2-fluorophenyl)-4-oxidanylidene-4-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)butanamide
MOLECULAR FORMULA: C18H16FN3O3
MOLECULAR WEIGHT: 341.336343
SMILES: C1C(=O)NC2=CC=CC=C2N1C(=O)CCC(=O)NC3=CC=CC=C3F
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Product OPENEYE NAME: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(3-chloro-2-methyl-phenyl)benzamide
CAS Name: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(3-chloro-2-methylphenyl)benzamide
IUPAC NAME: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(3-chloro-2-methylphenyl)benzamide
SYSTEMATIC NAME: N-(3-chloranyl-2-methyl-phenyl)-4-[[(4-ethanoylphenyl)sulfonylamino]methyl]benzamide
MOLECULAR FORMULA: C23H21ClN2O4S
MOLECULAR WEIGHT: 456.94184
SMILES: CC1=C(C=CC=C1Cl)NC(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)C(=O)C
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Product OPENEYE NAME: N-(3-chloro-2-methyl-phenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
CAS Name: N-(3-chloro-2-methylphenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
IUPAC NAME: N-(3-chloro-2-methylphenyl)-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
SYSTEMATIC NAME: N-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-4-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)butanamide
MOLECULAR FORMULA: C19H18ClN3O3
MOLECULAR WEIGHT: 371.81752
SMILES: CC1=C(C=CC=C1Cl)NC(=O)CCC(=O)N2CC(=O)NC3=CC=CC=C32
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Product OPENEYE NAME: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(2,4-dichlorophenyl)benzamide
CAS Name: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(2,4-dichlorophenyl)benzamide
IUPAC NAME: 4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(2,4-dichlorophenyl)benzamide
SYSTEMATIC NAME: N-(2,4-dichlorophenyl)-4-[[(4-ethanoylphenyl)sulfonylamino]methyl]benzamide
MOLECULAR FORMULA: C22H18Cl2N2O4S
MOLECULAR WEIGHT: 477.36032
SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Cl)Cl
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Product OPENEYE NAME: 2-[(5-chloro-2-thienyl)methylsulfanyl]-N-(2,4-dichlorophenyl)acetamide
CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]-N-(2,4-dichlorophenyl)acetamide
IUPAC NAME: 2-[(5-chlorothiophen-2-yl)methylsulfanyl]-N-(2,4-dichlorophenyl)acetamide
SYSTEMATIC NAME: 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-(2,4-dichlorophenyl)ethanamide
MOLECULAR FORMULA: C13H10Cl3NOS2
MOLECULAR WEIGHT: 366.7136
SMILES: C1=CC(=C(C=C1Cl)Cl)NC(=O)CSCC2=CC=C(S2)Cl
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