Wednesday, November 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 3-bromo-N2-[2-(1H-imidazol-5-yl)ethyl]-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
CAS Name: 3-bromo-N2-[2-(1H-imidazol-5-yl)ethyl]-N1-(4-pyrido[4,3-d]pyrimidinyl)benzene-1,2-diamine
IUPAC NAME: 3-bromo-2-N-[2-(1H-imidazol-5-yl)ethyl]-1-N-pyrido[4,3-d]pyrimidin-4-ylbenzene-1,2-diamine
SYSTEMATIC NAME: 3-bromanyl-N2-[2-(1H-imidazol-5-yl)ethyl]-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
MOLECULAR FORMULA: C18H16BrN7
MOLECULAR WEIGHT: 410.27054
SMILES: C1=CC(=C(C(=C1)Br)NCCC2=CN=CN2)NC3=NC=NC4=C3C=NC=C4
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Product OPENEYE NAME: 3-bromo-N2-[5-(dimethylamino)pentyl]-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
CAS Name: 3-bromo-N2-[5-(dimethylamino)pentyl]-N1-(4-pyrido[4,3-d]pyrimidinyl)benzene-1,2-diamine
IUPAC NAME: 3-bromo-2-N-[5-(dimethylamino)pentyl]-1-N-pyrido[4,3-d]pyrimidin-4-ylbenzene-1,2-diamine
SYSTEMATIC NAME: 3-bromanyl-N2-[5-(dimethylamino)pentyl]-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
MOLECULAR FORMULA: C20H25BrN6
MOLECULAR WEIGHT: 429.3567
SMILES: CN(C)CCCCCNC1=C(C=CC=C1Br)NC2=NC=NC3=C2C=NC=C3
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Product OPENEYE NAME: 4-bromo-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
CAS Name: 4-bromo-N1-(4-pyrido[4,3-d]pyrimidinyl)benzene-1,2-diamine
IUPAC NAME: 4-bromo-1-N-pyrido[4,3-d]pyrimidin-4-ylbenzene-1,2-diamine
SYSTEMATIC NAME: 4-bromanyl-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
MOLECULAR FORMULA: C13H10BrN5
MOLECULAR WEIGHT: 316.156
SMILES: C1=CC(=C(C=C1Br)N)NC2=NC=NC3=C2C=NC=C3
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Product OPENEYE NAME: N-(5-bromo-3-cyano-2-thienyl)-2-chloro-5-(diethylsulfamoyl)benzamide
CAS Name: N-(5-bromo-3-cyano-2-thiophenyl)-2-chloro-5-(diethylsulfamoyl)benzamide
IUPAC NAME: N-(5-bromo-3-cyanothiophen-2-yl)-2-chloro-5-(diethylsulfamoyl)benzamide
SYSTEMATIC NAME: N-(5-bromanyl-3-cyano-thiophen-2-yl)-2-chloranyl-5-(diethylsulfamoyl)benzamide
MOLECULAR FORMULA: C16H15BrClN3O3S2
MOLECULAR WEIGHT: 476.7956
SMILES: CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NC2=C(C=C(S2)Br)C#N
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Product OPENEYE NAME: methyl (2S)-3-hydroxy-2-[(5-methyl-1,1,3-trioxo-4-propyl-1,2,5-thiadiazolidin-2-yl)methylsulfonylamino]propanoate
CAS Name: (2S)-3-hydroxy-2-[(5-methyl-1,1,3-trioxo-4-propyl-1,2,5-thiadiazolidin-2-yl)methylsulfonylamino]propanoic acid methyl ester
IUPAC NAME: methyl (2S)-3-hydroxy-2-[(5-methyl-1,1,3-trioxo-4-propyl-1,2,5-thiadiazolidin-2-yl)methylsulfonylamino]propanoate
SYSTEMATIC NAME: methyl (2S)-2-[[5-methyl-1,1,3-tris(oxidanylidene)-4-propyl-1,2,5-thiadiazolidin-2-yl]methylsulfonylamino]-3-oxidanyl-propanoate
MOLECULAR FORMULA: C11H21N3O8S2
MOLECULAR WEIGHT: 387.42974
SMILES: CCCC1C(=O)N(S(=O)(=O)N1C)CS(=O)(=O)N[C@@H](CO)C(=O)OC
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Product OPENEYE NAME: 2-chloro-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-5-sulfamoyl-benzamide
CAS Name: 2-chloro-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-5-sulfamoylbenzamide
IUPAC NAME: 2-chloro-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-5-sulfamoylbenzamide
SYSTEMATIC NAME: 2-chloranyl-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-5-sulfamoyl-benzamide
MOLECULAR FORMULA: C15H12ClN3O3S2
MOLECULAR WEIGHT: 381.85708
SMILES: C1CC2=C(C1)SC(=C2C#N)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)Cl
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Product OPENEYE NAME: methyl (2S)-3-benzyloxy-2-[(5-methyl-1,1,3-trioxo-4-propyl-1,2,5-thiadiazolidin-2-yl)methylsulfonylamino]propanoate
CAS Name: (2S)-2-[(5-methyl-1,1,3-trioxo-4-propyl-1,2,5-thiadiazolidin-2-yl)methylsulfonylamino]-3-phenylmethoxypropanoic acid methyl ester
IUPAC NAME: methyl (2S)-2-[(5-methyl-1,1,3-trioxo-4-propyl-1,2,5-thiadiazolidin-2-yl)methylsulfonylamino]-3-phenylmethoxypropanoate
SYSTEMATIC NAME: methyl (2S)-2-[[5-methyl-1,1,3-tris(oxidanylidene)-4-propyl-1,2,5-thiadiazolidin-2-yl]methylsulfonylamino]-3-phenylmethoxy-propanoate
MOLECULAR FORMULA: C18H27N3O8S2
MOLECULAR WEIGHT: 477.55228
SMILES: CCCC1C(=O)N(S(=O)(=O)N1C)CS(=O)(=O)N[C@@H](COCC2=CC=CC=C2)C(=O)OC
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Product OPENEYE NAME: [2-chloro-4-[[1-(4-piperidylmethyl)-4-piperidyl]oxy]phenyl]methanol
CAS Name: [2-chloro-4-[[1-(4-piperidinylmethyl)-4-piperidinyl]oxy]phenyl]methanol
IUPAC NAME: [2-chloro-4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxyphenyl]methanol
SYSTEMATIC NAME: [2-chloranyl-4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxy-phenyl]methanol
MOLECULAR FORMULA: C18H27ClN2O2
MOLECULAR WEIGHT: 338.87218
SMILES: C1CNCCC1CN2CCC(CC2)OC3=CC(=C(C=C3)CO)Cl
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Product OPENEYE NAME: 2-[4-[[4-[3-chloro-4-(hydroxymethyl)phenoxy]-1-piperidyl]methyl]piperidine-1-carbonyl]benzoic acid
CAS Name: 2-[[4-[[4-[3-chloro-4-(hydroxymethyl)phenoxy]-1-piperidinyl]methyl]-1-piperidinyl]-oxomethyl]benzoic acid
IUPAC NAME: 2-[4-[[4-[3-chloro-4-(hydroxymethyl)phenoxy]piperidin-1-yl]methyl]piperidine-1-carbonyl]benzoic acid
SYSTEMATIC NAME: 2-[4-[[4-[3-chloranyl-4-(hydroxymethyl)phenoxy]piperidin-1-yl]methyl]piperidin-1-yl]carbonylbenzoic acid
MOLECULAR FORMULA: C26H31ClN2O5
MOLECULAR WEIGHT: 486.98774
SMILES: C1CN(CCC1CN2CCC(CC2)OC3=CC(=C(C=C3)CO)Cl)C(=O)C4=CC=CC=C4C(=O)O
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Product OPENEYE NAME: ethyl 1-(4-bromophenyl)-4-[5-methyl-1-phenyl-3-(phenylcarbamoyl)pyrazole-4-carbonyl]pyrazole-3-carboxylate
CAS Name: 4-[[3-[anilino(oxo)methyl]-5-methyl-1-phenyl-4-pyrazolyl]-oxomethyl]-1-(4-bromophenyl)-3-pyrazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-(4-bromophenyl)-4-[5-methyl-1-phenyl-3-(phenylcarbamoyl)pyrazole-4-carbonyl]pyrazole-3-carboxylate
SYSTEMATIC NAME: ethyl 1-(4-bromophenyl)-4-[5-methyl-1-phenyl-3-(phenylcarbamoyl)pyrazol-4-yl]carbonyl-pyrazole-3-carboxylate
MOLECULAR FORMULA: C30H24BrN5O4
MOLECULAR WEIGHT: 598.44666
SMILES: CCOC(=O)C1=NN(C=C1C(=O)C2=C(N(N=C2C(=O)NC3=CC=CC=C3)C4=CC=CC=C4)C)C5=CC=C(C=C5)Br
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