bis(methylsulfanyl)methyl-triphenyl-phosphanium tetrafluoroborate

Systemtic Name: bis(methylsulfanyl)methyl-triphenyl-phosphanium tetrafluoroborate Openeye Name: bis(methylsulfanyl)methyl-triphenyl-phosphonium tetrafluoroborate CAS Name: bis(methylthio)methyl-triphenylphosphonium tetrafluoroborate IUPAC Name: bis(methylsulfanyl)methyl-triphenylphosphanium tetrafluoroborate Traditional Name: bis(methylthio)methyl-triphenyl-phosphonium tetrafluoroborate Formula: C21H22BF4PS2 MolecularWeight: 456.307754

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CSC([P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)SC

Isomeric SMILES

[B-](F)(F)(F)F.CSC([P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)SC

InChI

InChI=1S/C21H22PS2.BF4/c1-23-21(24-2)22(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;2-1(3,4)5/h3-17,21H,1-2H3;/q+1;-1