Sunday, May 5, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [4-(3-chloro-4-fluoro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-[(2R)-2-ethyl-1-piperidyl]methanolate
CAS Name: [4-(3-chloro-4-fluorophenyl)sulfonylimino-1-cyclohexa-2,5-dienylidene]-[(2R)-2-ethyl-1-piperidinyl]methanolate
IUPAC NAME: [4-(3-chloro-4-fluorophenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-[(2R)-2-ethylpiperidin-1-yl]methanolate
SYSTEMATIC NAME: [4-(3-chloranyl-4-fluoranyl-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-[(2R)-2-ethylpiperidin-1-yl]methanolate
MOLECULAR FORMULA: C20H21ClFN2O3S-
MOLECULAR WEIGHT: 423.908743
SMILES: CC[C@@H]1CCCCN1C(=C2C=CC(=NS(=O)(=O)C3=CC(=C(C=C3)F)Cl)C=C2)[O-]
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Product OPENEYE NAME: 3-chloro-N-[4-[(2R)-2-ethylpiperidine-1-carbonyl]phenyl]-4-fluoro-benzenesulfonamide
CAS Name: 3-chloro-N-[4-[[(2R)-2-ethyl-1-piperidinyl]-oxomethyl]phenyl]-4-fluorobenzenesulfonamide
IUPAC NAME: 3-chloro-N-[4-[(2R)-2-ethylpiperidine-1-carbonyl]phenyl]-4-fluorobenzenesulfonamide
SYSTEMATIC NAME: 3-chloranyl-N-[4-[(2R)-2-ethylpiperidin-1-yl]carbonylphenyl]-4-fluoranyl-benzenesulfonamide
MOLECULAR FORMULA: C20H22ClFN2O3S
MOLECULAR WEIGHT: 424.916683
SMILES: CC[C@@H]1CCCCN1C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl
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Product OPENEYE NAME: [4-(3-chloro-4-fluoro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-[(2S)-2-ethyl-1-piperidyl]methanolate
CAS Name: [4-(3-chloro-4-fluorophenyl)sulfonylimino-1-cyclohexa-2,5-dienylidene]-[(2S)-2-ethyl-1-piperidinyl]methanolate
IUPAC NAME: [4-(3-chloro-4-fluorophenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-[(2S)-2-ethylpiperidin-1-yl]methanolate
SYSTEMATIC NAME: [4-(3-chloranyl-4-fluoranyl-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-[(2S)-2-ethylpiperidin-1-yl]methanolate
MOLECULAR FORMULA: C20H21ClFN2O3S-
MOLECULAR WEIGHT: 423.908743
SMILES: CC[C@H]1CCCCN1C(=C2C=CC(=NS(=O)(=O)C3=CC(=C(C=C3)F)Cl)C=C2)[O-]
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Product OPENEYE NAME: 3-chloro-N-[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-4-fluoro-benzenesulfonamide
CAS Name: 3-chloro-N-[4-[[(2S)-2-ethyl-1-piperidinyl]-oxomethyl]phenyl]-4-fluorobenzenesulfonamide
IUPAC NAME: 3-chloro-N-[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-4-fluorobenzenesulfonamide
SYSTEMATIC NAME: 3-chloranyl-N-[4-[(2S)-2-ethylpiperidin-1-yl]carbonylphenyl]-4-fluoranyl-benzenesulfonamide
MOLECULAR FORMULA: C20H22ClFN2O3S
MOLECULAR WEIGHT: 424.916683
SMILES: CC[C@H]1CCCCN1C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl
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Product OPENEYE NAME: [4-(methylcarbamoyl)phenyl] 3,4,5-trimethoxy-2-nitro-benzoate
CAS Name: 3,4,5-trimethoxy-2-nitrobenzoic acid [4-(methylcarbamoyl)phenyl] ester
IUPAC NAME: [4-(methylcarbamoyl)phenyl] 3,4,5-trimethoxy-2-nitrobenzoate
SYSTEMATIC NAME: [4-(methylcarbamoyl)phenyl] 3,4,5-trimethoxy-2-nitro-benzoate
MOLECULAR FORMULA: C18H18N2O8
MOLECULAR WEIGHT: 390.34412
SMILES: CNC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC
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Product OPENEYE NAME: 4-chloro-3-[(2R)-2-ethylpiperidine-1-carbonyl]-N-isopropyl-benzenesulfonamide
CAS Name: 4-chloro-3-[[(2R)-2-ethyl-1-piperidinyl]-oxomethyl]-N-propan-2-ylbenzenesulfonamide
IUPAC NAME: 4-chloro-3-[(2R)-2-ethylpiperidine-1-carbonyl]-N-propan-2-ylbenzenesulfonamide
SYSTEMATIC NAME: 4-chloranyl-3-[(2R)-2-ethylpiperidin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide
MOLECULAR FORMULA: C17H25ClN2O3S
MOLECULAR WEIGHT: 372.91
SMILES: CC[C@@H]1CCCCN1C(=O)C2=C(C=CC(=C2)S(=O)(=O)NC(C)C)Cl
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Product OPENEYE NAME: 4-chloro-3-[(2S)-2-ethylpiperidine-1-carbonyl]-N-isopropyl-benzenesulfonamide
CAS Name: 4-chloro-3-[[(2S)-2-ethyl-1-piperidinyl]-oxomethyl]-N-propan-2-ylbenzenesulfonamide
IUPAC NAME: 4-chloro-3-[(2S)-2-ethylpiperidine-1-carbonyl]-N-propan-2-ylbenzenesulfonamide
SYSTEMATIC NAME: 4-chloranyl-3-[(2S)-2-ethylpiperidin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide
MOLECULAR FORMULA: C17H25ClN2O3S
MOLECULAR WEIGHT: 372.91
SMILES: CC[C@H]1CCCCN1C(=O)C2=C(C=CC(=C2)S(=O)(=O)NC(C)C)Cl
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Product OPENEYE NAME: N-tert-butyl-5-[(2R)-2-ethylpiperidine-1-carbonyl]-2-methoxy-benzenesulfonamide
CAS Name: N-tert-butyl-5-[[(2R)-2-ethyl-1-piperidinyl]-oxomethyl]-2-methoxybenzenesulfonamide
IUPAC NAME: N-tert-butyl-5-[(2R)-2-ethylpiperidine-1-carbonyl]-2-methoxybenzenesulfonamide
SYSTEMATIC NAME: N-tert-butyl-5-[(2R)-2-ethylpiperidin-1-yl]carbonyl-2-methoxy-benzenesulfonamide
MOLECULAR FORMULA: C19H30N2O4S
MOLECULAR WEIGHT: 382.5175
SMILES: CC[C@@H]1CCCCN1C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)NC(C)(C)C
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Product OPENEYE NAME: N-tert-butyl-5-[(2S)-2-ethylpiperidine-1-carbonyl]-2-methoxy-benzenesulfonamide
CAS Name: N-tert-butyl-5-[[(2S)-2-ethyl-1-piperidinyl]-oxomethyl]-2-methoxybenzenesulfonamide
IUPAC NAME: N-tert-butyl-5-[(2S)-2-ethylpiperidine-1-carbonyl]-2-methoxybenzenesulfonamide
SYSTEMATIC NAME: N-tert-butyl-5-[(2S)-2-ethylpiperidin-1-yl]carbonyl-2-methoxy-benzenesulfonamide
MOLECULAR FORMULA: C19H30N2O4S
MOLECULAR WEIGHT: 382.5175
SMILES: CC[C@H]1CCCCN1C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)NC(C)(C)C
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Product OPENEYE NAME: [4-(methylcarbamoyl)phenyl] 4-ethoxy-5-methoxy-2-nitro-benzoate
CAS Name: 4-ethoxy-5-methoxy-2-nitrobenzoic acid [4-(methylcarbamoyl)phenyl] ester
IUPAC NAME: [4-(methylcarbamoyl)phenyl] 4-ethoxy-5-methoxy-2-nitrobenzoate
SYSTEMATIC NAME: [4-(methylcarbamoyl)phenyl] 4-ethoxy-5-methoxy-2-nitro-benzoate
MOLECULAR FORMULA: C18H18N2O7
MOLECULAR WEIGHT: 374.34472
SMILES: CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)OC2=CC=C(C=C2)C(=O)NC)OC
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Product OPENEYE NAME: 4-bromo-3-[(2R)-2-ethylpiperidine-1-carbonyl]benzenesulfonamide
CAS Name: 4-bromo-3-[[(2R)-2-ethyl-1-piperidinyl]-oxomethyl]benzenesulfonamide
IUPAC NAME: 4-bromo-3-[(2R)-2-ethylpiperidine-1-carbonyl]benzenesulfonamide
SYSTEMATIC NAME: 4-bromanyl-3-[(2R)-2-ethylpiperidin-1-yl]carbonyl-benzenesulfonamide
MOLECULAR FORMULA: C14H19BrN2O3S
MOLECULAR WEIGHT: 375.28126
SMILES: CC[C@@H]1CCCCN1C(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Br
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Product OPENEYE NAME: 4-bromo-3-[(2S)-2-ethylpiperidine-1-carbonyl]benzenesulfonamide
CAS Name: 4-bromo-3-[[(2S)-2-ethyl-1-piperidinyl]-oxomethyl]benzenesulfonamide
IUPAC NAME: 4-bromo-3-[(2S)-2-ethylpiperidine-1-carbonyl]benzenesulfonamide
SYSTEMATIC NAME: 4-bromanyl-3-[(2S)-2-ethylpiperidin-1-yl]carbonyl-benzenesulfonamide
MOLECULAR FORMULA: C14H19BrN2O3S
MOLECULAR WEIGHT: 375.28126
SMILES: CC[C@H]1CCCCN1C(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Br
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Product OPENEYE NAME: [(2R)-2-ethyl-1-piperidyl]-[1-[(E)-styryl]sulfonyl-4-piperidyl]methanone
CAS Name: [(2R)-2-ethyl-1-piperidinyl]-[1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinyl]methanone
IUPAC NAME: [(2R)-2-ethylpiperidin-1-yl]-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]methanone
SYSTEMATIC NAME: [(2R)-2-ethylpiperidin-1-yl]-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]methanone
MOLECULAR FORMULA: C21H30N2O3S
MOLECULAR WEIGHT: 390.5395
SMILES: CC[C@@H]1CCCCN1C(=O)C2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3
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Product OPENEYE NAME: [4-(methylcarbamoyl)phenyl] 4-ethylthiadiazole-5-carboxylate
CAS Name: 4-ethyl-5-thiadiazolecarboxylic acid [4-(methylcarbamoyl)phenyl] ester
IUPAC NAME: [4-(methylcarbamoyl)phenyl] 4-ethylthiadiazole-5-carboxylate
SYSTEMATIC NAME: [4-(methylcarbamoyl)phenyl] 4-ethyl-1,2,3-thiadiazole-5-carboxylate
MOLECULAR FORMULA: C13H13N3O3S
MOLECULAR WEIGHT: 291.32562
SMILES: CCC1=C(SN=N1)C(=O)OC2=CC=C(C=C2)C(=O)NC
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Product OPENEYE NAME: [(2S)-2-ethyl-1-piperidyl]-[1-[(E)-styryl]sulfonyl-4-piperidyl]methanone
CAS Name: [(2S)-2-ethyl-1-piperidinyl]-[1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinyl]methanone
IUPAC NAME: [(2S)-2-ethylpiperidin-1-yl]-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]methanone
SYSTEMATIC NAME: [(2S)-2-ethylpiperidin-1-yl]-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]methanone
MOLECULAR FORMULA: C21H30N2O3S
MOLECULAR WEIGHT: 390.5395
SMILES: CC[C@H]1CCCCN1C(=O)C2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3
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Product OPENEYE NAME: [4-(methylcarbamoyl)phenyl] 2-(3-chlorophenyl)-4-methyl-thiazole-5-carboxylate
CAS Name: 2-(3-chlorophenyl)-4-methyl-5-thiazolecarboxylic acid [4-(methylcarbamoyl)phenyl] ester
IUPAC NAME: [4-(methylcarbamoyl)phenyl] 2-(3-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: [4-(methylcarbamoyl)phenyl] 2-(3-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C19H15ClN2O3S
MOLECULAR WEIGHT: 386.852
SMILES: CC1=C(SC(=N1)C2=CC(=CC=C2)Cl)C(=O)OC3=CC=C(C=C3)C(=O)NC
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