Thursday, June 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: ethyl 3-oxo-2-tetrahydropyran-2-yl-1H-pyrazole-5-carboxylate
CAS Name: 2-(2-oxanyl)-3-oxo-1H-pyrazole-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-(oxan-2-yl)-3-oxo-1H-pyrazole-5-carboxylate
SYSTEMATIC NAME: ethyl 2-(oxan-2-yl)-3-oxidanylidene-1H-pyrazole-5-carboxylate
MOLECULAR FORMULA: C11H16N2O4
MOLECULAR WEIGHT: 240.25574
SMILES: CCOC(=O)C1=CC(=O)N(N1)C2CCCCO2
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Product OPENEYE NAME: ethyl 5-oxo-1-tetrahydropyran-2-yl-4H-pyrazole-3-carboxylate
CAS Name: 1-(2-oxanyl)-5-oxo-4H-pyrazole-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 1-(oxan-2-yl)-5-oxo-4H-pyrazole-3-carboxylate
SYSTEMATIC NAME: ethyl 1-(oxan-2-yl)-5-oxidanylidene-4H-pyrazole-3-carboxylate
MOLECULAR FORMULA: C11H16N2O4
MOLECULAR WEIGHT: 240.25574
SMILES: CCOC(=O)C1=NN(C(=O)C1)C2CCCCO2
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Product OPENEYE NAME: ethyl 2-[3-(5-ethoxycarbonyl-3-oxo-1H-pyrazol-2-yl)propyl]-3-oxo-1H-pyrazole-5-carboxylate
CAS Name: 2-[3-(5-ethoxycarbonyl-3-oxo-1H-pyrazol-2-yl)propyl]-3-oxo-1H-pyrazole-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[3-(5-ethoxycarbonyl-3-oxo-1H-pyrazol-2-yl)propyl]-3-oxo-1H-pyrazole-5-carboxylate
SYSTEMATIC NAME: ethyl 2-[3-(5-ethoxycarbonyl-3-oxidanylidene-1H-pyrazol-2-yl)propyl]-3-oxidanylidene-1H-pyrazole-5-carboxylate
MOLECULAR FORMULA: C15H20N4O6
MOLECULAR WEIGHT: 352.3425
SMILES: CCOC(=O)C1=CC(=O)N(N1)CCCN2C(=O)C=C(N2)C(=O)OCC
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Product OPENEYE NAME: 5-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)benzoic acid
CAS Name: 5-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)benzoic acid
IUPAC NAME: 5-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)benzoic acid
SYSTEMATIC NAME: 5-chloranyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)benzoic acid
MOLECULAR FORMULA: C15H12ClNO4
MOLECULAR WEIGHT: 305.71308
SMILES: C1COC2=C(O1)C=CC(=C2)NC3=C(C=C(C=C3)Cl)C(=O)O
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Product OPENEYE NAME: 9,11-dichloro-2,3-dihydro-[1,4]dioxino[2,3-b]acridine
CAS Name: 9,11-dichloro-2,3-dihydro-[1,4]dioxino[2,3-b]acridine
IUPAC NAME: 9,11-dichloro-2,3-dihydro-[1,4]dioxino[2,3-b]acridine
SYSTEMATIC NAME: 9,11-bis(chloranyl)-2,3-dihydro-[1,4]dioxino[2,3-b]acridine
MOLECULAR FORMULA: C15H9Cl2NO2
MOLECULAR WEIGHT: 306.14346
SMILES: C1COC2=C(O1)C=C3C(=C2)N=C4C=CC(=CC4=C3Cl)Cl
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Product OPENEYE NAME: N-[4-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)-3-methoxy-phenyl]methanesulfonamide
CAS Name: N-[4-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)-3-methoxyphenyl]methanesulfonamide
IUPAC NAME: N-[4-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)-3-methoxyphenyl]methanesulfonamide
SYSTEMATIC NAME: N-[4-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)-3-methoxy-phenyl]methanesulfonamide
MOLECULAR FORMULA: C23H21N3O5S
MOLECULAR WEIGHT: 451.49494
SMILES: COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=C4C(=CC3=NC5=CC=CC=C52)OCCO4
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Product OPENEYE NAME: N-[4-[(9-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-yl)amino]phenyl]methanesulfonamide
CAS Name: N-[4-[(9-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-yl)amino]phenyl]methanesulfonamide
IUPAC NAME: N-[4-[(9-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-yl)amino]phenyl]methanesulfonamide
SYSTEMATIC NAME: N-[4-[(9-chloranyl-2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-yl)amino]phenyl]methanesulfonamide
MOLECULAR FORMULA: C22H18ClN3O4S
MOLECULAR WEIGHT: 455.91402
SMILES: CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=C(C=CC3=NC4=CC5=C(C=C42)OCCO5)Cl
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Product OPENEYE NAME: N-[3-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)phenyl]methanesulfonamide
CAS Name: N-[3-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)phenyl]methanesulfonamide
IUPAC NAME: N-[3-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)phenyl]methanesulfonamide
SYSTEMATIC NAME: N-[3-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)phenyl]methanesulfonamide
MOLECULAR FORMULA: C22H19N3O4S
MOLECULAR WEIGHT: 421.46896
SMILES: CS(=O)(=O)NC1=CC=CC(=C1)NC2=C3C=C4C(=CC3=NC5=CC=CC=C52)OCCO4
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Product OPENEYE NAME: N-[4-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)-2-methyl-phenyl]methanesulfonamide
CAS Name: N-[4-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)-2-methylphenyl]methanesulfonamide
IUPAC NAME: N-[4-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)-2-methylphenyl]methanesulfonamide
SYSTEMATIC NAME: N-[4-(2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-ylamino)-2-methyl-phenyl]methanesulfonamide
MOLECULAR FORMULA: C23H21N3O4S
MOLECULAR WEIGHT: 435.49554
SMILES: CC1=C(C=CC(=C1)NC2=C3C=C4C(=CC3=NC5=CC=CC=C52)OCCO4)NS(=O)(=O)C
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Product OPENEYE NAME: N-phenyl-2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-amine
CAS Name: N-phenyl-2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-amine
IUPAC NAME: N-phenyl-2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-amine
SYSTEMATIC NAME: N-phenyl-2,3-dihydro-[1,4]dioxino[2,3-b]acridin-11-amine
MOLECULAR FORMULA: C21H16N2O2
MOLECULAR WEIGHT: 328.36394
SMILES: C1COC2=CC3=NC4=CC=CC=C4C(=C3C=C2O1)NC5=CC=CC=C5
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Product OPENEYE NAME: methyl (2R)-3-acetyl-2-ethyl-1-oxo-1,3-thiazolidine-2-carboxylate
CAS Name: (2R)-3-acetyl-2-ethyl-1-oxo-1,3-thiazolidine-2-carboxylic acid methyl ester
IUPAC NAME: methyl (2R)-3-acetyl-2-ethyl-1-oxo-1,3-thiazolidine-2-carboxylate
SYSTEMATIC NAME: methyl (2R)-3-ethanoyl-2-ethyl-1-oxidanylidene-1,3-thiazolidine-2-carboxylate
MOLECULAR FORMULA: C9H15NO4S
MOLECULAR WEIGHT: 233.2847
SMILES: CC[C@]1(N(CCS1=O)C(=O)C)C(=O)OC
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Product OPENEYE NAME: (2R)-3-acetyl-2-ethyl-1-oxo-N-phenyl-1,3-thiazolidine-2-carboxamide
CAS Name: (2R)-3-acetyl-2-ethyl-1-oxo-N-phenyl-1,3-thiazolidine-2-carboxamide
IUPAC NAME: (2R)-3-acetyl-2-ethyl-1-oxo-N-phenyl-1,3-thiazolidine-2-carboxamide
SYSTEMATIC NAME: (2R)-3-ethanoyl-2-ethyl-1-oxidanylidene-N-phenyl-1,3-thiazolidine-2-carboxamide
MOLECULAR FORMULA: C14H18N2O3S
MOLECULAR WEIGHT: 294.36932
SMILES: CC[C@]1(N(CCS1=O)C(=O)C)C(=O)NC2=CC=CC=C2
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Product OPENEYE NAME: methyl (2S)-3-acetyl-2-ethyl-1-oxo-1,3-thiazolidine-2-carboxylate
CAS Name: (2S)-3-acetyl-2-ethyl-1-oxo-1,3-thiazolidine-2-carboxylic acid methyl ester
IUPAC NAME: methyl (2S)-3-acetyl-2-ethyl-1-oxo-1,3-thiazolidine-2-carboxylate
SYSTEMATIC NAME: methyl (2S)-3-ethanoyl-2-ethyl-1-oxidanylidene-1,3-thiazolidine-2-carboxylate
MOLECULAR FORMULA: C9H15NO4S
MOLECULAR WEIGHT: 233.2847
SMILES: CC[C@@]1(N(CCS1=O)C(=O)C)C(=O)OC
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Product OPENEYE NAME: (2S)-3-acetyl-2-ethyl-1-oxo-N-phenyl-1,3-thiazolidine-2-carboxamide
CAS Name: (2S)-3-acetyl-2-ethyl-1-oxo-N-phenyl-1,3-thiazolidine-2-carboxamide
IUPAC NAME: (2S)-3-acetyl-2-ethyl-1-oxo-N-phenyl-1,3-thiazolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-3-ethanoyl-2-ethyl-1-oxidanylidene-N-phenyl-1,3-thiazolidine-2-carboxamide
MOLECULAR FORMULA: C14H18N2O3S
MOLECULAR WEIGHT: 294.36932
SMILES: CC[C@@]1(N(CCS1=O)C(=O)C)C(=O)NC2=CC=CC=C2
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Product OPENEYE NAME: methyl 6-methyl-3,4-dihydro-2H-1,4-thiazine-5-carboxylate
CAS Name: 6-methyl-3,4-dihydro-2H-1,4-thiazine-5-carboxylic acid methyl ester
IUPAC NAME: methyl 6-methyl-3,4-dihydro-2H-1,4-thiazine-5-carboxylate
SYSTEMATIC NAME: methyl 6-methyl-3,4-dihydro-2H-1,4-thiazine-5-carboxylate
MOLECULAR FORMULA: C7H11NO2S
MOLECULAR WEIGHT: 173.23274
SMILES: CC1=C(NCCS1)C(=O)OC
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Product OPENEYE NAME: methyl 4-acetyl-6-methyl-2,3-dihydro-1,4-thiazine-5-carboxylate
CAS Name: 4-acetyl-6-methyl-2,3-dihydro-1,4-thiazine-5-carboxylic acid methyl ester
IUPAC NAME: methyl 4-acetyl-6-methyl-2,3-dihydro-1,4-thiazine-5-carboxylate
SYSTEMATIC NAME: methyl 4-ethanoyl-6-methyl-2,3-dihydro-1,4-thiazine-5-carboxylate
MOLECULAR FORMULA: C9H13NO3S
MOLECULAR WEIGHT: 215.26942
SMILES: CC1=C(N(CCS1)C(=O)C)C(=O)OC
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