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

Systemtic Name: [4-ethylsulfanyl-2-(4-methylphenyl)-6-oxidanylidene-1H-pyrimidin-5-yl]-triphenyl-phosphanium Openeye Name: [4-ethylsulfanyl-6-oxo-2-(p-tolyl)-1H-pyrimidin-5-yl]-triphenyl-phosphonium CAS Name: [4-(ethylthio)-2-(4-methylphenyl)-6-oxo-1H-pyrimidin-5-yl]-triphenylphosphonium IUPAC Name: [4-ethylsulfanyl-2-(4-methylphenyl)-6-oxo-1H-pyrimidin-5-yl]-triphenylphosphanium Traditional Name: [4-(ethylthio)-6-keto-2-(p-tolyl)-1H-pyrimidin-5-yl]-triphenyl-phosphonium Formula: C31H28N2OPS+ MolecularWeight: 507.605581

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=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

CCSC1=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/C31H27N2OPS/c1-3-36-31-28(30(34)32-29(33-31)24-21-19-23(2)20-22-24)35(25-13-7-4-8-14-25,26-15-9-5-10-16-26)27-17-11-6-12-18-27/h4-22H,3H2,1-2H3/p+1