[2-(4-methylphenyl)-4-methylsulfanyl-6-oxidanylidene-1H-pyrimidin-5-yl]-triphenyl-phosphanium

Systemtic Name: [2-(4-methylphenyl)-4-methylsulfanyl-6-oxidanylidene-1H-pyrimidin-5-yl]-triphenyl-phosphanium Openeye Name: [4-methylsulfanyl-6-oxo-2-(p-tolyl)-1H-pyrimidin-5-yl]-triphenyl-phosphonium CAS Name: [2-(4-methylphenyl)-4-(methylthio)-6-oxo-1H-pyrimidin-5-yl]-triphenylphosphonium IUPAC Name: [2-(4-methylphenyl)-4-methylsulfanyl-6-oxo-1H-pyrimidin-5-yl]-triphenylphosphanium Traditional Name: [6-keto-4-(methylthio)-2-(p-tolyl)-1H-pyrimidin-5-yl]-triphenyl-phosphonium Formula: C30H26N2OPS+ MolecularWeight: 493.579001

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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)SC

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)SC

InChI

InChI=1S/C30H25N2OPS/c1-22-18-20-23(21-19-22)28-31-29(33)27(30(32-28)35-2)34(24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-21H,1-2H3/p+1