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

Systemtic Name: [2-(4-methylphenyl)-6-oxidanylidene-4-propylsulfanyl-1H-pyrimidin-5-yl]-triphenyl-phosphanium Openeye Name: [6-oxo-4-propylsulfanyl-2-(p-tolyl)-1H-pyrimidin-5-yl]-triphenyl-phosphonium CAS Name: [2-(4-methylphenyl)-6-oxo-4-(propylthio)-1H-pyrimidin-5-yl]-triphenylphosphonium IUPAC Name: [2-(4-methylphenyl)-6-oxo-4-propylsulfanyl-1H-pyrimidin-5-yl]-triphenylphosphanium Traditional Name: [6-keto-4-(propylthio)-2-(p-tolyl)-1H-pyrimidin-5-yl]-triphenyl-phosphonium Formula: C32H30N2OPS+ MolecularWeight: 521.632161

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C(=O)NC(=N1)C2=CC=C(C=C2)C)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCSC1=C(C(=O)NC(=N1)C2=CC=C(C=C2)C)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H29N2OPS/c1-3-23-37-32-29(31(35)33-30(34-32)25-21-19-24(2)20-22-25)36(26-13-7-4-8-14-26,27-15-9-5-10-16-27)28-17-11-6-12-18-28/h4-22H,3,23H2,1-2H3/p+1