Friday, March 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(methylcarbamoyl)-2-[4-(2-naphthylsulfonyl)piperazin-1-yl]acetamide
CAS Name: N-(methylcarbamoyl)-2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]acetamide
IUPAC NAME: N-(methylcarbamoyl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)acetamide
SYSTEMATIC NAME: N-(methylcarbamoyl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanamide
MOLECULAR FORMULA: C18H22N4O4S
MOLECULAR WEIGHT: 390.45668
SMILES: CNC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: 5-(4-fluorophenyl)-3-[[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylmethyl]-4-methyl-isoxazole
CAS Name: 5-(4-fluorophenyl)-3-[[[1-(4-methoxyphenyl)-5-tetrazolyl]thio]methyl]-4-methylisoxazole
IUPAC NAME: 5-(4-fluorophenyl)-3-[[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylmethyl]-4-methyl-1,2-oxazole
SYSTEMATIC NAME: 5-(4-fluorophenyl)-3-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-4-methyl-1,2-oxazole
MOLECULAR FORMULA: C19H16FN5O2S
MOLECULAR WEIGHT: 397.426043
SMILES: CC1=C(ON=C1CSC2=NN=NN2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)F
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Product OPENEYE NAME: (2R)-2-[[(E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]amino]-N-propyl-propanamide
CAS Name: (2R)-2-[[(E)-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-1-oxoprop-2-enyl]amino]-N-propylpropanamide
IUPAC NAME: (2R)-2-[[(E)-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)prop-2-enoyl]amino]-N-propylpropanamide
SYSTEMATIC NAME: (2R)-2-[[(E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]amino]-N-propyl-propanamide
MOLECULAR FORMULA: C18H27N3O2
MOLECULAR WEIGHT: 317.42588
SMILES: CCCNC(=O)[C@@H](C)NC(=O)/C=C/C1=C(N(C(=C1)C)C2CC2)C
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Product OPENEYE NAME: [2-oxo-2-[[(1S)-tetralin-1-yl]amino]ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-oxo-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl] ester
IUPAC NAME: [2-oxo-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C22H21NO4
MOLECULAR WEIGHT: 363.40644
SMILES: C1C[C@@H](C2=CC=CC=C2C1)NC(=O)COC(=O)C3=CC4=CC=CC=C4OC3
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Product OPENEYE NAME: ethyl N-[2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetyl]carbamate
CAS Name: N-[2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-1-oxoethyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)acetyl]carbamate
SYSTEMATIC NAME: ethyl N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanoyl]carbamate
MOLECULAR FORMULA: C19H24N3O5S+
MOLECULAR WEIGHT: 406.47596
SMILES: CCOC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: ethyl N-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]acetyl]carbamate
CAS Name: N-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-1-oxoethyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)acetyl]carbamate
SYSTEMATIC NAME: ethyl N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanoyl]carbamate
MOLECULAR FORMULA: C19H23N3O5S
MOLECULAR WEIGHT: 405.46802
SMILES: CCOC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: 2-[(3-chloro-4-fluoro-phenyl)carbamothioylamino]ethyl-diisopropyl-ammonium
CAS Name: 2-[[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]amino]ethyl-di(propan-2-yl)ammonium
IUPAC NAME: 2-[(3-chloro-4-fluorophenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium
SYSTEMATIC NAME: 2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium
MOLECULAR FORMULA: C15H24ClFN3S+
MOLECULAR WEIGHT: 332.887563
SMILES: CC(C)[NH+](CCNC(=S)NC1=CC(=C(C=C1)F)Cl)C(C)C
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Product OPENEYE NAME: 1-(3-chloro-4-fluoro-phenyl)-3-[2-(diisopropylamino)ethyl]thiourea
CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[2-[di(propan-2-yl)amino]ethyl]thiourea
IUPAC NAME: 1-(3-chloro-4-fluorophenyl)-3-[2-[di(propan-2-yl)amino]ethyl]thiourea
SYSTEMATIC NAME: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-[di(propan-2-yl)amino]ethyl]thiourea
MOLECULAR FORMULA: C15H23ClFN3S
MOLECULAR WEIGHT: 331.879623
SMILES: CC(C)N(CCNC(=S)NC1=CC(=C(C=C1)F)Cl)C(C)C
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Product OPENEYE NAME: methyl 5-[[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]methyl]furan-2-carboxylate
CAS Name: 5-[[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]methyl]-2-furancarboxylic acid methyl ester
IUPAC NAME: methyl 5-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]furan-2-carboxylate
SYSTEMATIC NAME: methyl 5-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]furan-2-carboxylate
MOLECULAR FORMULA: C21H23N2O5S+
MOLECULAR WEIGHT: 415.48272
SMILES: COC(=O)C1=CC=C(O1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3
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