Saturday, July 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]terephthalamide dihydrochloride
CAS Name: N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide dihydrochloride
IUPAC NAME: 1-N,4-N-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide dihydrochloride
SYSTEMATIC NAME: N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide dihydrochloride
MOLECULAR FORMULA: C26H28Cl2N8O2
MOLECULAR WEIGHT: 555.45892
SMILES: C1CN=C(N1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=NCCN5.Cl.Cl
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Product OPENEYE NAME: N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]terephthalamide
CAS Name: N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide
IUPAC NAME: 1-N,4-N-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide
SYSTEMATIC NAME: N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide
MOLECULAR FORMULA: C26H26N8O2
MOLECULAR WEIGHT: 482.53704
SMILES: C1CN=C(N1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=NCCN5
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Product OPENEYE NAME: [3-(dimethylcarbamoyloxy)phenyl]-trimethyl-ammonium bromide
CAS Name: [3-[dimethylamino(oxo)methoxy]phenyl]-trimethylammonium bromide
IUPAC NAME: [3-(dimethylcarbamoyloxy)phenyl]-trimethylazanium bromide
SYSTEMATIC NAME: [3-(dimethylcarbamoyloxy)phenyl]-trimethyl-azanium bromide
MOLECULAR FORMULA: C12H19BrN2O2
MOLECULAR WEIGHT: 303.19546
SMILES: CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.[Br-]
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Product OPENEYE NAME: N'-phenylacetohydrazide
CAS Name: N'-phenylacetohydrazide
IUPAC NAME: N'-phenylacetohydrazide
SYSTEMATIC NAME: N'-phenylethanehydrazide
MOLECULAR FORMULA: C8H10N2O
MOLECULAR WEIGHT: 150.1778
SMILES: CC(=O)NNC1=CC=CC=C1
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Product OPENEYE NAME: (N-benzyl-N'-methyl-carbamimidoyl)-methyl-ammonium sulfate
CAS Name: methyl-[methylimino-[(phenylmethyl)amino]methyl]ammonium sulfate
IUPAC NAME: (N-benzyl-N'-methylcarbamimidoyl)-methylazanium sulfate
SYSTEMATIC NAME: methyl-[N'-methyl-N-(phenylmethyl)carbamimidoyl]azanium sulfate
MOLECULAR FORMULA: C20H32N6O4S
MOLECULAR WEIGHT: 452.57088
SMILES: C[NH2+]C(=NC)NCC1=CC=CC=C1.C[NH2+]C(=NC)NCC1=CC=CC=C1.[O-]S(=O)(=O)[O-]
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Product OPENEYE NAME: 1-(diaminomethylene)-2-(2-phenylethyl)guanidine
CAS Name: 1-(diaminomethylidene)-2-(2-phenylethyl)guanidine
IUPAC NAME: 1-(diaminomethylidene)-2-(2-phenylethyl)guanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-(2-phenylethyl)guanidine
MOLECULAR FORMULA: C10H15N5
MOLECULAR WEIGHT: 205.2596
SMILES: C1=CC=C(C=C1)CCN=C(N)N=C(N)N
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Product OPENEYE NAME: prop-1-ene
CAS Name: 1-propene
IUPAC NAME: prop-1-ene
SYSTEMATIC NAME: prop-1-ene
MOLECULAR FORMULA: C3H6
MOLECULAR WEIGHT: 42.07974
SMILES: CC=C
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Product OPENEYE NAME: methylmercury(1+) chloride
CAS Name: methylmercury(1+) chloride
IUPAC NAME: methylmercury(1+) chloride
SYSTEMATIC NAME: methylmercury(1+) chloride
MOLECULAR FORMULA: CH3ClHg
MOLECULAR WEIGHT: 251.07752
SMILES: C[Hg+].[Cl-]
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Product OPENEYE NAME: methoxymethane
CAS Name: methoxymethane
IUPAC NAME: methoxymethane
SYSTEMATIC NAME: methoxymethane
MOLECULAR FORMULA: C2H6O
MOLECULAR WEIGHT: 46.06844
SMILES: COC
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Product OPENEYE NAME: 2-methylprop-1-ene
CAS Name: 2-methyl-1-propene
IUPAC NAME: 2-methylprop-1-ene
SYSTEMATIC NAME: 2-methylprop-1-ene
MOLECULAR FORMULA: C4H8
MOLECULAR WEIGHT: 56.10632
SMILES: CC(=C)C
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Product OPENEYE NAME: 2,2,2-tribromoacetaldehyde
CAS Name: 2,2,2-tribromoacetaldehyde
IUPAC NAME: 2,2,2-tribromoacetaldehyde
SYSTEMATIC NAME: 2,2,2-tris(bromanyl)ethanal
MOLECULAR FORMULA: C2HBr3O
MOLECULAR WEIGHT: 280.74074
SMILES: C(=O)C(Br)(Br)Br
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Product OPENEYE NAME: 2-methylbut-3-en-2-ol
CAS Name: 2-methyl-3-buten-2-ol
IUPAC NAME: 2-methylbut-3-en-2-ol
SYSTEMATIC NAME: 2-methylbut-3-en-2-ol
MOLECULAR FORMULA: C5H10O
MOLECULAR WEIGHT: 86.1323
SMILES: CC(C)(C=C)O
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Product OPENEYE NAME: 2-methylbut-3-yn-2-ol
CAS Name: 2-methyl-3-butyn-2-ol
IUPAC NAME: 2-methylbut-3-yn-2-ol
SYSTEMATIC NAME: 2-methylbut-3-yn-2-ol
MOLECULAR FORMULA: C5H8O
MOLECULAR WEIGHT: 84.11642
SMILES: CC(C)(C#C)O
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Product OPENEYE NAME: 2,2,2-trichloroethanol
CAS Name: 2,2,2-trichloroethanol
IUPAC NAME: 2,2,2-trichloroethanol
SYSTEMATIC NAME: 2,2,2-tris(chloranyl)ethanol
MOLECULAR FORMULA: C2H3Cl3O
MOLECULAR WEIGHT: 149.40362
SMILES: C(C(Cl)(Cl)Cl)O
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Product OPENEYE NAME: trichloro(ethyl)silane
CAS Name: trichloro(ethyl)silane
IUPAC NAME: trichloro(ethyl)silane
SYSTEMATIC NAME: tris(chloranyl)-ethyl-silane
MOLECULAR FORMULA: C2H5Cl3Si
MOLECULAR WEIGHT: 163.5056
SMILES: CC[Si](Cl)(Cl)Cl
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Product OPENEYE NAME: 3-hydroxy-3-methyl-butan-2-one
CAS Name: 3-hydroxy-3-methyl-2-butanone
IUPAC NAME: 3-hydroxy-3-methylbutan-2-one
SYSTEMATIC NAME: 3-methyl-3-oxidanyl-butan-2-one
MOLECULAR FORMULA: C5H10O2
MOLECULAR WEIGHT: 102.1317
SMILES: CC(=O)C(C)(C)O
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