(4-methylphenyl)sulfanyl-triphenyl-phosphanium bromide

Systemtic Name: (4-methylphenyl)sulfanyl-triphenyl-phosphanium bromide Openeye Name: triphenyl(p-tolylsulfanyl)phosphonium bromide CAS Name: [(4-methylphenyl)thio]-triphenylphosphonium bromide IUPAC Name: (4-methylphenyl)sulfanyl-triphenylphosphanium bromide Traditional Name: triphenyl-(p-tolylthio)phosphonium bromide Formula: C25H22BrPS MolecularWeight: 465.384941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)S[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C25H22PS.BrH/c1-21-17-19-25(20-18-21)27-26(22-11-5-2-6-12-22,23-13-7-3-8-14-23)24-15-9-4-10-16-24;/h2-20H,1H3;1H/q+1;/p-1