Sunday, April 28, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-(2-methylselanylphenyl)sulfonyl-urea
CAS Name: 1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(methylseleno)phenyl]sulfonylurea
IUPAC NAME: 1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-(2-methylselanylphenyl)sulfonylurea
SYSTEMATIC NAME: 1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-(2-methylselanylphenyl)sulfonyl-urea
MOLECULAR FORMULA: C13H15N5O4SSe
MOLECULAR WEIGHT: 416.3143
SMILES: CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2[Se]C
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Product OPENEYE NAME: methyl 2-[(4-methoxy-6-methylselanyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate
CAS Name: 2-[[[[4-methoxy-6-(methylseleno)-2-pyrimidinyl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester
IUPAC NAME: methyl 2-[(4-methoxy-6-methylselanylpyrimidin-2-yl)carbamoylsulfamoyl]benzoate
SYSTEMATIC NAME: methyl 2-[(4-methoxy-6-methylselanyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate
MOLECULAR FORMULA: C15H16N4O6SSe
MOLECULAR WEIGHT: 459.33574
SMILES: COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)[Se]C
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Product OPENEYE NAME: 1-(4-methoxy-6-methylselanyl-pyrimidin-2-yl)-3-(2-methylsulfonylphenyl)sulfonyl-urea
CAS Name: 1-[4-methoxy-6-(methylseleno)-2-pyrimidinyl]-3-(2-methylsulfonylphenyl)sulfonylurea
IUPAC NAME: 1-(4-methoxy-6-methylselanylpyrimidin-2-yl)-3-(2-methylsulfonylphenyl)sulfonylurea
SYSTEMATIC NAME: 1-(4-methoxy-6-methylselanyl-pyrimidin-2-yl)-3-(2-methylsulfonylphenyl)sulfonyl-urea
MOLECULAR FORMULA: C14H16N4O6S2Se
MOLECULAR WEIGHT: 479.39004
SMILES: COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2S(=O)(=O)C)[Se]C
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Product OPENEYE NAME: 5-piperazin-1-ylindolin-2-one
CAS Name: 5-(1-piperazinyl)-1,3-dihydroindol-2-one
IUPAC NAME: 5-piperazin-1-yl-1,3-dihydroindol-2-one
SYSTEMATIC NAME: 5-piperazin-1-yl-1,3-dihydroindol-2-one
MOLECULAR FORMULA: C12H15N3O
MOLECULAR WEIGHT: 217.267
SMILES: C1CN(CCN1)C2=CC3=C(C=C2)NC(=O)C3
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Product OPENEYE NAME: 5-piperazin-1-ylindolin-2-one hydrobromide
CAS Name: 5-(1-piperazinyl)-1,3-dihydroindol-2-one hydrobromide
IUPAC NAME: 5-piperazin-1-yl-1,3-dihydroindol-2-one hydrobromide
SYSTEMATIC NAME: 5-piperazin-1-yl-1,3-dihydroindol-2-one hydrobromide
MOLECULAR FORMULA: C12H16BrN3O
MOLECULAR WEIGHT: 298.17894
SMILES: C1CN(CCN1)C2=CC3=C(C=C2)NC(=O)C3.Br
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Product OPENEYE NAME: 5-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]indolin-2-one
CAS Name: 5-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-1,3-dihydroindol-2-one
IUPAC NAME: 5-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-1,3-dihydroindol-2-one
SYSTEMATIC NAME: 5-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-1,3-dihydroindol-2-one
MOLECULAR FORMULA: C21H23N3O4
MOLECULAR WEIGHT: 381.42502
SMILES: COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)NC(=O)C4)OC
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Product OPENEYE NAME: 5-[4-(4-ethoxybenzoyl)piperazin-1-yl]indolin-2-one
CAS Name: 5-[4-[(4-ethoxyphenyl)-oxomethyl]-1-piperazinyl]-1,3-dihydroindol-2-one
IUPAC NAME: 5-[4-(4-ethoxybenzoyl)piperazin-1-yl]-1,3-dihydroindol-2-one
SYSTEMATIC NAME: 5-[4-(4-ethoxyphenyl)carbonylpiperazin-1-yl]-1,3-dihydroindol-2-one
MOLECULAR FORMULA: C21H23N3O3
MOLECULAR WEIGHT: 365.42562
SMILES: CCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)NC(=O)C4
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Product OPENEYE NAME: 5-[4-(4-methylbenzoyl)piperazin-1-yl]indolin-2-one
CAS Name: 5-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-1,3-dihydroindol-2-one
IUPAC NAME: 5-[4-(4-methylbenzoyl)piperazin-1-yl]-1,3-dihydroindol-2-one
SYSTEMATIC NAME: 5-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-1,3-dihydroindol-2-one
MOLECULAR FORMULA: C20H21N3O2
MOLECULAR WEIGHT: 335.39964
SMILES: CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)NC(=O)C4
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Product OPENEYE NAME: ethyl 4-(2-oxoindolin-5-yl)piperazine-1-carboxylate
CAS Name: 4-(2-oxo-1,3-dihydroindol-5-yl)-1-piperazinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-(2-oxo-1,3-dihydroindol-5-yl)piperazine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-(2-oxidanylidene-1,3-dihydroindol-5-yl)piperazine-1-carboxylate
MOLECULAR FORMULA: C15H19N3O3
MOLECULAR WEIGHT: 289.32966
SMILES: CCOC(=O)N1CCN(CC1)C2=CC3=C(C=C2)NC(=O)C3
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Product OPENEYE NAME: 5-(4-benzylpiperazin-1-yl)indolin-2-one
CAS Name: 5-[4-(phenylmethyl)-1-piperazinyl]-1,3-dihydroindol-2-one
IUPAC NAME: 5-(4-benzylpiperazin-1-yl)-1,3-dihydroindol-2-one
SYSTEMATIC NAME: 5-[4-(phenylmethyl)piperazin-1-yl]-1,3-dihydroindol-2-one
MOLECULAR FORMULA: C19H21N3O
MOLECULAR WEIGHT: 307.38954
SMILES: C1CN(CCN1CC2=CC=CC=C2)C3=CC4=C(C=C3)NC(=O)C4
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Product OPENEYE NAME: (2E,6E,10E,14E)-N,N-diethyl-2,6,10,14-tetramethyl-18-oxo-nonadeca-2,6,10,14-tetraenamide
CAS Name: (2E,6E,10E,14E)-N,N-diethyl-2,6,10,14-tetramethyl-18-oxononadeca-2,6,10,14-tetraenamide
IUPAC NAME: (2E,6E,10E,14E)-N,N-diethyl-2,6,10,14-tetramethyl-18-oxononadeca-2,6,10,14-tetraenamide
SYSTEMATIC NAME: (2E,6E,10E,14E)-N,N-diethyl-2,6,10,14-tetramethyl-18-oxidanylidene-nonadeca-2,6,10,14-tetraenamide
MOLECULAR FORMULA: C27H45NO2
MOLECULAR WEIGHT: 415.6517
SMILES: CCN(CC)C(=O)/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CCC(=O)C)/C)/C)/C)/C
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Product OPENEYE NAME: (2E,6E,10E,14E)-2,6,10,14-tetramethyl-18-oxo-N,N-dipropyl-nonadeca-2,6,10,14-tetraenamide
CAS Name: (2E,6E,10E,14E)-2,6,10,14-tetramethyl-18-oxo-N,N-dipropylnonadeca-2,6,10,14-tetraenamide
IUPAC NAME: (2E,6E,10E,14E)-2,6,10,14-tetramethyl-18-oxo-N,N-dipropylnonadeca-2,6,10,14-tetraenamide
SYSTEMATIC NAME: (2E,6E,10E,14E)-2,6,10,14-tetramethyl-18-oxidanylidene-N,N-dipropyl-nonadeca-2,6,10,14-tetraenamide
MOLECULAR FORMULA: C29H49NO2
MOLECULAR WEIGHT: 443.70486
SMILES: CCCN(CCC)C(=O)/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CCC(=O)C)/C)/C)/C)/C
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Product OPENEYE NAME: (2E,6E,10E,14E)-N,N-diisopropyl-2,6,10,14-tetramethyl-18-oxo-nonadeca-2,6,10,14-tetraenamide
CAS Name: (2E,6E,10E,14E)-2,6,10,14-tetramethyl-18-oxo-N,N-di(propan-2-yl)nonadeca-2,6,10,14-tetraenamide
IUPAC NAME: (2E,6E,10E,14E)-2,6,10,14-tetramethyl-18-oxo-N,N-di(propan-2-yl)nonadeca-2,6,10,14-tetraenamide
SYSTEMATIC NAME: (2E,6E,10E,14E)-2,6,10,14-tetramethyl-18-oxidanylidene-N,N-di(propan-2-yl)nonadeca-2,6,10,14-tetraenamide
MOLECULAR FORMULA: C29H49NO2
MOLECULAR WEIGHT: 443.70486
SMILES: CC(C)N(C(C)C)C(=O)/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CCC(=O)C)/C)/C)/C)/C
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Product OPENEYE NAME: (2E,6E,10E,14E,18E)-N,N,2,6,10,14,18-heptamethyl-22-oxo-tricosa-2,6,10,14,18-pentaenamide
CAS Name: (2E,6E,10E,14E,18E)-N,N,2,6,10,14,18-heptamethyl-22-oxotricosa-2,6,10,14,18-pentaenamide
IUPAC NAME: (2E,6E,10E,14E,18E)-N,N,2,6,10,14,18-heptamethyl-22-oxotricosa-2,6,10,14,18-pentaenamide
SYSTEMATIC NAME: (2E,6E,10E,14E,18E)-N,N,2,6,10,14,18-heptamethyl-22-oxidanylidene-tricosa-2,6,10,14,18-pentaenamide
MOLECULAR FORMULA: C30H49NO2
MOLECULAR WEIGHT: 455.71556
SMILES: C/C(=C\CC/C(=C/CCC(=O)C)/C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C(=O)N(C)C
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Product OPENEYE NAME: ethyl (2E,6E,10E)-12-(dimethylamino)-3,7,11-trimethyl-12-oxo-dodeca-2,6,10-trienoate
CAS Name: (2E,6E,10E)-12-(dimethylamino)-3,7,11-trimethyl-12-oxododeca-2,6,10-trienoic acid ethyl ester
IUPAC NAME: ethyl (2E,6E,10E)-12-(dimethylamino)-3,7,11-trimethyl-12-oxododeca-2,6,10-trienoate
SYSTEMATIC NAME: ethyl (2E,6E,10E)-12-(dimethylamino)-3,7,11-trimethyl-12-oxidanylidene-dodeca-2,6,10-trienoate
MOLECULAR FORMULA: C19H31NO3
MOLECULAR WEIGHT: 321.45434
SMILES: CCOC(=O)/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C(=O)N(C)C
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Product OPENEYE NAME: 4-[(E)-2-(3-tert-butylphenyl)vinyl]benzoic acid
CAS Name: 4-[(E)-2-(3-tert-butylphenyl)ethenyl]benzoic acid
IUPAC NAME: 4-[(E)-2-(3-tert-butylphenyl)ethenyl]benzoic acid
SYSTEMATIC NAME: 4-[(E)-2-(3-tert-butylphenyl)ethenyl]benzoic acid
MOLECULAR FORMULA: C19H20O2
MOLECULAR WEIGHT: 280.3609
SMILES: CC(C)(C)C1=CC=CC(=C1)/C=C/C2=CC=C(C=C2)C(=O)O
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Product OPENEYE NAME: 4-[(E)-2-(3,4-dimethylphenyl)prop-1-enyl]benzoic acid
CAS Name: 4-[(E)-2-(3,4-dimethylphenyl)prop-1-enyl]benzoic acid
IUPAC NAME: 4-[(E)-2-(3,4-dimethylphenyl)prop-1-enyl]benzoic acid
SYSTEMATIC NAME: 4-[(E)-2-(3,4-dimethylphenyl)prop-1-enyl]benzoic acid
MOLECULAR FORMULA: C18H18O2
MOLECULAR WEIGHT: 266.33432
SMILES: CC1=C(C=C(C=C1)/C(=C/C2=CC=C(C=C2)C(=O)O)/C)C
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Product OPENEYE NAME: 4-[(E)-2-(3,4-diethylphenyl)prop-1-enyl]benzoic acid
CAS Name: 4-[(E)-2-(3,4-diethylphenyl)prop-1-enyl]benzoic acid
IUPAC NAME: 4-[(E)-2-(3,4-diethylphenyl)prop-1-enyl]benzoic acid
SYSTEMATIC NAME: 4-[(E)-2-(3,4-diethylphenyl)prop-1-enyl]benzoic acid
MOLECULAR FORMULA: C20H22O2
MOLECULAR WEIGHT: 294.38748
SMILES: CCC1=C(C=C(C=C1)/C(=C/C2=CC=C(C=C2)C(=O)O)/C)CC
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Product OPENEYE NAME: 4-[(E)-2-(3,4-diisopropylphenyl)prop-1-enyl]benzoic acid
CAS Name: 4-[(E)-2-[3,4-di(propan-2-yl)phenyl]prop-1-enyl]benzoic acid
IUPAC NAME: 4-[(E)-2-[3,4-di(propan-2-yl)phenyl]prop-1-enyl]benzoic acid
SYSTEMATIC NAME: 4-[(E)-2-[3,4-di(propan-2-yl)phenyl]prop-1-enyl]benzoic acid
MOLECULAR FORMULA: C22H26O2
MOLECULAR WEIGHT: 322.44064
SMILES: CC(C)C1=C(C=C(C=C1)/C(=C/C2=CC=C(C=C2)C(=O)O)/C)C(C)C
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