Friday, December 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2-[(1,4-dimethylpiperazin-2-yl)methoxy]-4-fluoro-6-(2-fluoro-4-iodo-anilino)benzamide
CAS Name: 2-[(1,4-dimethyl-2-piperazinyl)methoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
IUPAC NAME: 2-[(1,4-dimethylpiperazin-2-yl)methoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
SYSTEMATIC NAME: 2-[(1,4-dimethylpiperazin-2-yl)methoxy]-4-fluoranyl-6-[(2-fluoranyl-4-iodanyl-phenyl)amino]benzamide
MOLECULAR FORMULA: C20H23F2IN4O2
MOLECULAR WEIGHT: 516.323496
SMILES: CN1CCN(C(C1)COC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N)C
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Product OPENEYE NAME: 2-[[1-(benzenesulfonyl)-3-piperidyl]methoxy]-4-fluoro-6-(2-fluoro-4-iodo-anilino)benzamide
CAS Name: 2-[[1-(benzenesulfonyl)-3-piperidinyl]methoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
IUPAC NAME: 2-[[1-(benzenesulfonyl)piperidin-3-yl]methoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
SYSTEMATIC NAME: 4-fluoranyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-6-[[1-(phenylsulfonyl)piperidin-3-yl]methoxy]benzamide
MOLECULAR FORMULA: C25H24F2IN3O4S
MOLECULAR WEIGHT: 627.442036
SMILES: C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)COC3=C(C(=CC(=C3)F)NC4=C(C=C(C=C4)I)F)C(=O)N
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Product OPENEYE NAME: 2-[(1-ethylsulfonyl-3-piperidyl)methoxy]-4-fluoro-6-(2-fluoro-4-iodo-anilino)benzamide
CAS Name: 2-[(1-ethylsulfonyl-3-piperidinyl)methoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
IUPAC NAME: 2-[(1-ethylsulfonylpiperidin-3-yl)methoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
SYSTEMATIC NAME: 2-[(1-ethylsulfonylpiperidin-3-yl)methoxy]-4-fluoranyl-6-[(2-fluoranyl-4-iodanyl-phenyl)amino]benzamide
MOLECULAR FORMULA: C21H24F2IN3O4S
MOLECULAR WEIGHT: 579.399236
SMILES: CCS(=O)(=O)N1CCCC(C1)COC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N
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Product OPENEYE NAME: 2-[2-(1-ethylsulfonyl-2-piperidyl)ethoxy]-4-fluoro-6-(2-fluoro-4-iodo-anilino)benzamide
CAS Name: 2-[2-(1-ethylsulfonyl-2-piperidinyl)ethoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
IUPAC NAME: 2-[2-(1-ethylsulfonylpiperidin-2-yl)ethoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
SYSTEMATIC NAME: 2-[2-(1-ethylsulfonylpiperidin-2-yl)ethoxy]-4-fluoranyl-6-[(2-fluoranyl-4-iodanyl-phenyl)amino]benzamide
MOLECULAR FORMULA: C22H26F2IN3O4S
MOLECULAR WEIGHT: 593.425816
SMILES: CCS(=O)(=O)N1CCCCC1CCOC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N
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Product OPENEYE NAME: 4-fluoro-2-(2-fluoro-4-iodo-anilino)-6-[(1-methylsulfonyl-3-piperidyl)methoxy]benzamide
CAS Name: 4-fluoro-2-(2-fluoro-4-iodoanilino)-6-[(1-methylsulfonyl-3-piperidinyl)methoxy]benzamide
IUPAC NAME: 4-fluoro-2-(2-fluoro-4-iodoanilino)-6-[(1-methylsulfonylpiperidin-3-yl)methoxy]benzamide
SYSTEMATIC NAME: 4-fluoranyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-6-[(1-methylsulfonylpiperidin-3-yl)methoxy]benzamide
MOLECULAR FORMULA: C20H22F2IN3O4S
MOLECULAR WEIGHT: 565.372656
SMILES: CS(=O)(=O)N1CCCC(C1)COC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N
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Product OPENEYE NAME: tert-butyl 3-[[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodo-anilino)phenoxy]methyl]piperazine-1-carboxylate
CAS Name: 3-[[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]methyl]-1-piperazinecarboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 3-[[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]methyl]piperazine-1-carboxylate
SYSTEMATIC NAME: tert-butyl 3-[[2-aminocarbonyl-5-fluoranyl-3-[(2-fluoranyl-4-iodanyl-phenyl)amino]phenoxy]methyl]piperazine-1-carboxylate
MOLECULAR FORMULA: C23H27F2IN4O4
MOLECULAR WEIGHT: 588.386156
SMILES: CC(C)(C)OC(=O)N1CCNC(C1)COC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N
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Product OPENEYE NAME: 1-naphthyl 2-(1-tert-butoxycarbonyl-4-piperidyl)thiazole-4-carboxylate
CAS Name: 2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinyl]-4-thiazolecarboxylic acid 1-naphthalenyl ester
IUPAC NAME: naphthalen-1-yl 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: naphthalen-1-yl 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C24H26N2O4S
MOLECULAR WEIGHT: 438.53924
SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)OC3=CC=CC4=CC=CC=C43
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Product OPENEYE NAME: cyclohexyl 2-(4-piperidyl)thiazole-4-carboxylate hydrochloride
CAS Name: 2-(4-piperidinyl)-4-thiazolecarboxylic acid cyclohexyl ester hydrochloride
IUPAC NAME: cyclohexyl 2-piperidin-4-yl-1,3-thiazole-4-carboxylate hydrochloride
SYSTEMATIC NAME: cyclohexyl 2-piperidin-4-yl-1,3-thiazole-4-carboxylate hydrochloride
MOLECULAR FORMULA: C15H23ClN2O2S
MOLECULAR WEIGHT: 330.87332
SMILES: C1CCC(CC1)OC(=O)C2=CSC(=N2)C3CCNCC3.Cl
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Product OPENEYE NAME: cyclohexyl 2-(4-piperidyl)thiazole-4-carboxylate
CAS Name: 2-(4-piperidinyl)-4-thiazolecarboxylic acid cyclohexyl ester
IUPAC NAME: cyclohexyl 2-piperidin-4-yl-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: cyclohexyl 2-piperidin-4-yl-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C15H22N2O2S
MOLECULAR WEIGHT: 294.41238
SMILES: C1CCC(CC1)OC(=O)C2=CSC(=N2)C3CCNCC3
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Product OPENEYE NAME: 1-naphthyl 2-(4-piperidyl)thiazole-4-carboxylate hydrochloride
CAS Name: 2-(4-piperidinyl)-4-thiazolecarboxylic acid 1-naphthalenyl ester hydrochloride
IUPAC NAME: naphthalen-1-yl 2-piperidin-4-yl-1,3-thiazole-4-carboxylate hydrochloride
SYSTEMATIC NAME: naphthalen-1-yl 2-piperidin-4-yl-1,3-thiazole-4-carboxylate hydrochloride
MOLECULAR FORMULA: C19H19ClN2O2S
MOLECULAR WEIGHT: 374.88436
SMILES: C1CNCCC1C2=NC(=CS2)C(=O)OC3=CC=CC4=CC=CC=C43.Cl
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Product OPENEYE NAME: 1-naphthyl 2-(4-piperidyl)thiazole-4-carboxylate
CAS Name: 2-(4-piperidinyl)-4-thiazolecarboxylic acid 1-naphthalenyl ester
IUPAC NAME: naphthalen-1-yl 2-piperidin-4-yl-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: naphthalen-1-yl 2-piperidin-4-yl-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C19H18N2O2S
MOLECULAR WEIGHT: 338.42342
SMILES: C1CNCCC1C2=NC(=CS2)C(=O)OC3=CC=CC4=CC=CC=C43
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Product OPENEYE NAME: (1R,3S)-5',7-dichloro-6-fluoro-3-methyl-spiro[2,3,4,9-tetrahydropyrido[3,4-b]indole-1,3'-indoline]-2'-one
CAS Name: (3R,3'S)-5,7'-dichloro-6'-fluoro-3'-methyl-2-spiro[1H-indole-3,1'-2,3,4,9-tetrahydropyrido[3,4-b]indole]one
IUPAC NAME: (3R,3'S)-5,7'-dichloro-6'-fluoro-3'-methylspiro[1H-indole-3,1'-2,3,4,9-tetrahydropyrido[3,4-b]indole]-2-one
SYSTEMATIC NAME: (3R,3'S)-5,7'-bis(chloranyl)-6'-fluoranyl-3'-methyl-spiro[1H-indole-3,1'-2,3,4,9-tetrahydropyrido[3,4-b]indole]-2-one
MOLECULAR FORMULA: C19H14Cl2FN3O
MOLECULAR WEIGHT: 390.238363
SMILES: C[C@H]1CC2=C([C@]3(N1)C4=C(C=CC(=C4)Cl)NC3=O)NC5=CC(=C(C=C25)F)Cl
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Product OPENEYE NAME: (1R,3S)-5'-chloro-6-fluoro-3-methyl-spiro[2,3,4,9-tetrahydropyrido[3,4-b]indole-1,3'-indoline]-2'-one
CAS Name: (3R,3'S)-5-chloro-6'-fluoro-3'-methyl-2-spiro[1H-indole-3,1'-2,3,4,9-tetrahydropyrido[3,4-b]indole]one
IUPAC NAME: (3R,3'S)-5-chloro-6'-fluoro-3'-methylspiro[1H-indole-3,1'-2,3,4,9-tetrahydropyrido[3,4-b]indole]-2-one
SYSTEMATIC NAME: (3R,3'S)-5-chloranyl-6'-fluoranyl-3'-methyl-spiro[1H-indole-3,1'-2,3,4,9-tetrahydropyrido[3,4-b]indole]-2-one
MOLECULAR FORMULA: C19H15ClFN3O
MOLECULAR WEIGHT: 355.793303
SMILES: C[C@H]1CC2=C([C@]3(N1)C4=C(C=CC(=C4)Cl)NC3=O)NC5=C2C=C(C=C5)F
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Product OPENEYE NAME: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-1-amine
CAS Name: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-1-propanamine
IUPAC NAME: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-1-amine
SYSTEMATIC NAME: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-1-amine
MOLECULAR FORMULA: C13H19NO4S
MOLECULAR WEIGHT: 285.35926
SMILES: CCCNCC1COC2=C(O1)C=C(C=C2)S(=O)(=O)C
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