2,4,6-triphenyl-1-(2-phenylsulfanylethyl)pyridin-1-ium tetrafluoroborate

Systemtic Name: 2,4,6-triphenyl-1-(2-phenylsulfanylethyl)pyridin-1-ium tetrafluoroborate Openeye Name: 2,4,6-triphenyl-1-(2-phenylsulfanylethyl)pyridin-1-ium tetrafluoroborate CAS Name: 2,4,6-triphenyl-1-[2-(phenylthio)ethyl]pyridin-1-ium tetrafluoroborate IUPAC Name: 2,4,6-triphenyl-1-(2-phenylsulfanylethyl)pyridin-1-ium tetrafluoroborate Traditional Name: 2,4,6-triphenyl-1-[2-(phenylthio)ethyl]pyridin-1-ium tetrafluoroborate Formula: C31H26BF4NS MolecularWeight: 531.414453

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)CCSC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)CCSC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H26NS.BF4/c1-5-13-25(14-6-1)28-23-30(26-15-7-2-8-16-26)32(21-22-33-29-19-11-4-12-20-29)31(24-28)27-17-9-3-10-18-27;2-1(3,4)5/h1-20,23-24H,21-22H2;/q+1;-1