Tuesday, April 2, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(2-methylallyl)-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine-1-carbothioamide
CAS Name: 4-(2-methyl-5-nitrophenyl)sulfonyl-N-(2-methylprop-2-enyl)-1-piperazinecarbothioamide
IUPAC NAME: 4-(2-methyl-5-nitrophenyl)sulfonyl-N-(2-methylprop-2-enyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: 4-(2-methyl-5-nitro-phenyl)sulfonyl-N-(2-methylprop-2-enyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C16H22N4O4S2
MOLECULAR WEIGHT: 398.50028
SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=S)NCC(=C)C
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Product OPENEYE NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-isopentyl-acetamide
CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(3-methylbutyl)acetamide
IUPAC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-methylbutyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-methylbutyl)ethanamide
MOLECULAR FORMULA: C19H32N3O3S+
MOLECULAR WEIGHT: 382.54068
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCCC(C)C
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Product OPENEYE NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-isopentyl-acetamide
CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(3-methylbutyl)acetamide
IUPAC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-methylbutyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-methylbutyl)ethanamide
MOLECULAR FORMULA: C19H31N3O3S
MOLECULAR WEIGHT: 381.53274
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NCCC(C)C
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Product OPENEYE NAME: [2-(3,4-dichloroanilino)-2-oxo-ethyl] (2S)-2-(butylsulfonylamino)propanoate
CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid [2-(3,4-dichloroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(3,4-dichloroanilino)-2-oxoethyl] (2S)-2-(butylsulfonylamino)propanoate
SYSTEMATIC NAME: [2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(butylsulfonylamino)propanoate
MOLECULAR FORMULA: C15H20Cl2N2O5S
MOLECULAR WEIGHT: 411.3007
SMILES: CCCCS(=O)(=O)N[C@@H](C)C(=O)OCC(=O)NC1=CC(=C(C=C1)Cl)Cl
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Product OPENEYE NAME: [(1S)-2-(4-carbamoylanilino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2S)-1-(4-carbamoylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-carbamoylanilino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-[(4-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H18N2O5
MOLECULAR WEIGHT: 366.36732
SMILES: C[C@@H](C(=O)NC1=CC=C(C=C1)C(=O)N)OC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-[(4-fluorophenyl)thio]ethyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C22H30FN3OS+2
MOLECULAR WEIGHT: 403.556503
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CCSC3=CC=C(C=C3)F
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-[(4-fluorophenyl)thio]ethyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C22H28FN3OS
MOLECULAR WEIGHT: 401.540623
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CCSC3=CC=C(C=C3)F
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Product OPENEYE NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-isobutyl-acetamide
CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-methylpropyl)acetamide
IUPAC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylpropyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylpropyl)ethanamide
MOLECULAR FORMULA: C18H30N3O3S+
MOLECULAR WEIGHT: 368.5141
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC(C)C
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Product OPENEYE NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-isobutyl-acetamide
CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(2-methylpropyl)acetamide
IUPAC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylpropyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylpropyl)ethanamide
MOLECULAR FORMULA: C18H29N3O3S
MOLECULAR WEIGHT: 367.50616
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NCC(C)C
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