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

Systemtic Name: [4-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-6-oxidanylidene-1H-pyrimidin-5-yl]-triphenyl-phosphanium chloride Openeye Name: [4-(2-methoxy-2-oxo-ethyl)sulfanyl-2-methyl-6-oxo-1H-pyrimidin-5-yl]-triphenyl-phosphonium chloride CAS Name: [4-[(2-methoxy-2-oxoethyl)thio]-2-methyl-6-oxo-1H-pyrimidin-5-yl]-triphenylphosphonium chloride IUPAC Name: [4-(2-methoxy-2-oxoethyl)sulfanyl-2-methyl-6-oxo-1H-pyrimidin-5-yl]-triphenylphosphanium chloride Traditional Name: [6-keto-4-[(2-keto-2-methoxy-ethyl)thio]-2-methyl-1H-pyrimidin-5-yl]-triphenyl-phosphonium chloride Formula: C26H24ClN2O3PS MolecularWeight: 510.972121

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=O)N1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)SCC(=O)OC.[Cl-]

Isomeric SMILES

CC1=NC(=C(C(=O)N1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)SCC(=O)OC.[Cl-]

InChI

InChI=1S/C26H23N2O3PS.ClH/c1-19-27-25(30)24(26(28-19)33-18-23(29)31-2)32(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22;/h3-17H,18H2,1-2H3;1H