Sunday, March 31, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3R,5S)-3,5-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2R)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-[(3R,5S)-3,5-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C20H31ClN3O3S+
MOLECULAR WEIGHT: 428.99644
SMILES: C[C@@H]1C[C@@H](CN(C1)C(=O)[C@@H](C)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C
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Product OPENEYE NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(3S,5R)-3,5-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2R)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-1-[(3S,5R)-3,5-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(3S,5R)-3,5-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(3S,5R)-3,5-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C20H30ClN3O3S
MOLECULAR WEIGHT: 427.9885
SMILES: C[C@@H]1C[C@@H](CN(C1)C(=O)[C@@H](C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C
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Product OPENEYE NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3S,5S)-3,5-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2R)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C20H31ClN3O3S+
MOLECULAR WEIGHT: 428.99644
SMILES: C[C@H]1C[C@@H](CN(C1)C(=O)[C@@H](C)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C
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Product OPENEYE NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(3S,5S)-3,5-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2R)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-1-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C20H30ClN3O3S
MOLECULAR WEIGHT: 427.9885
SMILES: C[C@H]1C[C@@H](CN(C1)C(=O)[C@@H](C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C
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Product OPENEYE NAME: 2-(2-fluorophenoxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide
CAS Name: 2-(2-fluorophenoxy)-N-[2-[(2-fluorophenyl)methylthio]ethyl]acetamide
IUPAC NAME: 2-(2-fluorophenoxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide
SYSTEMATIC NAME: 2-(2-fluoranylphenoxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]ethanamide
MOLECULAR FORMULA: C17H17F2NO2S
MOLECULAR WEIGHT: 337.384186
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)COC2=CC=CC=C2F)F
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Product OPENEYE NAME: 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(3,4-dimethylphenyl)benzamide
CAS Name: 4-[[(2R,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]-N-(3,4-dimethylphenyl)benzamide
IUPAC NAME: 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(3,4-dimethylphenyl)benzamide
SYSTEMATIC NAME: 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(3,4-dimethylphenyl)benzamide
MOLECULAR FORMULA: C21H26N2O4S
MOLECULAR WEIGHT: 402.50714
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)C)C
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Product OPENEYE NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3R,5R)-3,5-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2R)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C20H31ClN3O3S+
MOLECULAR WEIGHT: 428.99644
SMILES: C[C@@H]1C[C@H](CN(C1)C(=O)[C@@H](C)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C
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Product OPENEYE NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(3R,5R)-3,5-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2R)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-1-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C20H30ClN3O3S
MOLECULAR WEIGHT: 427.9885
SMILES: C[C@@H]1C[C@H](CN(C1)C(=O)[C@@H](C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C
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Product OPENEYE NAME: [2-(methylcarbamoylamino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(methylcarbamoylamino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C14H14N2O5
MOLECULAR WEIGHT: 290.27136
SMILES: CNC(=O)NC(=O)COC(=O)C1=CC2=CC=CC=C2OC1
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Product OPENEYE NAME: 1-[2-[(5Z)-5-[(2-chlorophenyl)methylene]-2,4-dioxo-thiazolidin-3-yl]ethyl]-3-ethyl-thiourea
CAS Name: 1-[2-[(5Z)-5-[(2-chlorophenyl)methylidene]-2,4-dioxo-3-thiazolidinyl]ethyl]-3-ethylthiourea
IUPAC NAME: 1-[2-[(5Z)-5-[(2-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-ethylthiourea
SYSTEMATIC NAME: 1-[2-[(5Z)-5-[(2-chlorophenyl)methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethyl]-3-ethyl-thiourea
MOLECULAR FORMULA: C15H16ClN3O2S2
MOLECULAR WEIGHT: 369.88944
SMILES: CCNC(=S)NCCN1C(=O)/C(=C/C2=CC=CC=C2Cl)/SC1=O
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Product OPENEYE NAME: 4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(3,4-dimethylphenyl)benzamide
CAS Name: 4-[[(2R,6R)-2,6-dimethyl-4-morpholinyl]sulfonyl]-N-(3,4-dimethylphenyl)benzamide
IUPAC NAME: 4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(3,4-dimethylphenyl)benzamide
SYSTEMATIC NAME: 4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(3,4-dimethylphenyl)benzamide
MOLECULAR FORMULA: C21H26N2O4S
MOLECULAR WEIGHT: 402.50714
SMILES: C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)C)C
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Product OPENEYE NAME: [2-oxo-2-(2-oxooxazolidin-3-yl)ethyl] 2-[(3-methylbenzoyl)amino]acetate
CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]acetic acid [2-oxo-2-(2-oxo-3-oxazolidinyl)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-[(3-methylbenzoyl)amino]acetate
SYSTEMATIC NAME: [2-oxidanylidene-2-(2-oxidanylidene-1,3-oxazolidin-3-yl)ethyl] 2-[(3-methylphenyl)carbonylamino]ethanoate
MOLECULAR FORMULA: C15H16N2O6
MOLECULAR WEIGHT: 320.29734
SMILES: CC1=CC=CC(=C1)C(=O)NCC(=O)OCC(=O)N2CCOC2=O
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-[(2-phenoxyacetyl)amino]acetamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-[(1-oxo-2-phenoxyethyl)amino]acetamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-[(2-phenoxyacetyl)amino]acetamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-(2-phenoxyethanoylamino)ethanamide
MOLECULAR FORMULA: C19H21FN2O3S
MOLECULAR WEIGHT: 376.445043
SMILES: C1=CC=C(C=C1)OCC(=O)NCC(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: 1-[2-[(5Z)-5-[(2-chlorophenyl)methylene]-2,4-dioxo-thiazolidin-3-yl]ethyl]-3-(2-methoxyethyl)thiourea
CAS Name: 1-[2-[(5Z)-5-[(2-chlorophenyl)methylidene]-2,4-dioxo-3-thiazolidinyl]ethyl]-3-(2-methoxyethyl)thiourea
IUPAC NAME: 1-[2-[(5Z)-5-[(2-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-(2-methoxyethyl)thiourea
SYSTEMATIC NAME: 1-[2-[(5Z)-5-[(2-chlorophenyl)methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethyl]-3-(2-methoxyethyl)thiourea
MOLECULAR FORMULA: C16H18ClN3O3S2
MOLECULAR WEIGHT: 399.91542
SMILES: COCCNC(=S)NCCN1C(=O)/C(=C/C2=CC=CC=C2Cl)/SC1=O
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Product OPENEYE NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(2R,6S)-2,6-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2R)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-[(2R,6S)-2,6-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C20H31ClN3O3S+
MOLECULAR WEIGHT: 428.99644
SMILES: C[C@@H]1CCC[C@@H](N1C(=O)[C@@H](C)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C
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Product OPENEYE NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(2S,6R)-2,6-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2R)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-1-[(2S,6R)-2,6-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2R)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C20H30ClN3O3S
MOLECULAR WEIGHT: 427.9885
SMILES: C[C@@H]1CCC[C@@H](N1C(=O)[C@@H](C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C
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