[4-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-(4-methylphenyl)-6-oxidanylidene-1H-pyrimidin-5-yl]-triphenyl-phosphanium chloride

Systemtic Name: [4-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-(4-methylphenyl)-6-oxidanylidene-1H-pyrimidin-5-yl]-triphenyl-phosphanium chloride Openeye Name: [4-(2-methoxy-2-oxo-ethyl)sulfanyl-6-oxo-2-(p-tolyl)-1H-pyrimidin-5-yl]-triphenyl-phosphonium chloride CAS Name: [4-[(2-methoxy-2-oxoethyl)thio]-2-(4-methylphenyl)-6-oxo-1H-pyrimidin-5-yl]-triphenylphosphonium chloride IUPAC Name: [4-(2-methoxy-2-oxoethyl)sulfanyl-2-(4-methylphenyl)-6-oxo-1H-pyrimidin-5-yl]-triphenylphosphanium chloride Traditional Name: [6-keto-4-[(2-keto-2-methoxy-ethyl)thio]-2-(p-tolyl)-1H-pyrimidin-5-yl]-triphenyl-phosphonium chloride Formula: C32H28ClN2O3PS MolecularWeight: 587.068081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)SCC(=O)OC.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)SCC(=O)OC.[Cl-]

InChI

InChI=1S/C32H27N2O3PS.ClH/c1-23-18-20-24(21-19-23)30-33-31(36)29(32(34-30)39-22-28(35)37-2)38(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27;/h3-21H,22H2,1-2H3;1H