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sodium; [(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methyl-amino]methanesulfonate; methyl sulfate; 2-oxidanylpropane-1,2,3-tricarboxylic acid; 5-phenyl-5-piperidin-1-yl-1,3-bis(2-piperidin-1-ylethyl)-1,3-diazinane-2,4,6-trione; trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium

sodium; [(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methyl-amino]methanesulfonate; methyl sulfate; 2-oxidanylpropane-1,2,3-tricarboxylic acid; 5-phenyl-5-piperidin-1-yl-1,3-bis(2-piperidin-1-ylethyl)-1,3-diazinane-2,4,6-trione; trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium

Systemtic Name:sodium; [(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methyl-amino]methanesulfonate; methyl sulfate; 2-oxidanylpropane-1,2,3-tricarboxylic acid; 5-phenyl-5-piperidin-1-yl-1,3-bis(2-piperidin-1-ylethyl)-1,3-diazinane-2,4,6-trione; trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium
Openeye Name:sodium; citric acid; [(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-methyl-amino]methanesulfonate; methyl sulfate; 5-phenyl-5-(1-piperidyl)-1,3-bis[2-(1-piperidyl)ethyl]hexahydropyrimidine-2,4,6-trione; trimethyl-(1-methyl-2-phenothiazin-10-yl-ethyl)ammonium
CAS Name:sodium; [(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-methylamino]methanesulfonate; 2-hydroxypropane-1,2,3-tricarboxylic acid; methyl sulfate; 5-phenyl-5-(1-piperidinyl)-1,3-bis[2-(1-piperidinyl)ethyl]-1,3-diazinane-2,4,6-trione; trimethyl-[1-(10-phenothiazinyl)propan-2-yl]ammonium
IUPAC Name:sodium; [(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-methylamino]methanesulfonate; 2-hydroxypropane-1,2,3-tricarboxylic acid; methyl sulfate; 5-phenyl-5-piperidin-1-yl-1,3-bis(2-piperidin-1-ylethyl)-1,3-diazinane-2,4,6-trione; trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium
Traditional Name:sodium; citric acid; [(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-methyl-amino]methanesulfonate; methyl sulfate; 5-phenyl-5-piperidino-1,3-bis(2-piperidinoethyl)barbituric acid; trimethyl-(1-methyl-2-phenothiazin-10-yl-ethyl)ammonium
Formula: C73H101N10NaO25S3
MolecularWeight: 1637.81981
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)CS(=O)(=O)[O-].CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)[N+](C)(C)C.COS(=O)(=O)[O-].C1CCN(CC1)CCN2C(=O)C(C(=O)N(C2=O)CCN3CCCCC3)(C4=CC=CC=C4)N5CCCCC5.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Na+]


Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)CS(=O)(=O)[O-].CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)[N+](C)(C)C.COS(=O)(=O)[O-].C1CCN(CC1)CCN2C(=O)C(C(=O)N(C2=O)CCN3CCCCC3)(C4=CC=CC=C4)N5CCCCC5.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Na+]


InChI

InChI=1S/C29H43N5O3.C18H23N2S.C13H17N3O4S.2C6H8O7.CH4O4S.Na/c35-26-29(25-13-5-1-6-14-25,32-19-11-4-12-20-32)27(36)34(24-22-31-17-9-3-10-18-31)28(37)33(26)23-21-30-15-7-2-8-16-30;1-14(20(2,3)4)13-19-15-9-5-7-11-17(15)21-18-12-8-6-10-16(18)19;1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11;2*7-3(8)1-6(13,5(11)12)2-4(9)10;1-5-6(2,3)4;/h1,5-6,13-14H,2-4,7-12,15-24H2;5-12,14H,13H2,1-4H3;4-8H,9H2,1-3H3,(H,18,19,20);2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1H3,(H,2,3,4);/q;+1;;;;;+1/p-2


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