1-methyl-2-(phenylmethylsulfanyl)pyridin-1-ium

Systemtic Name: 1-methyl-2-(phenylmethylsulfanyl)pyridin-1-ium Openeye Name: 2-benzylsulfanyl-1-methyl-pyridin-1-ium CAS Name: 1-methyl-2-(phenylmethylthio)pyridin-1-ium IUPAC Name: 2-benzylsulfanyl-1-methylpyridin-1-ium Traditional Name: 2-(benzylthio)-1-methyl-pyridin-1-ium Formula: C13H14NS+ MolecularWeight: 216.32196

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1SCC2=CC=CC=C2

Isomeric SMILES

C[N+]1=CC=CC=C1SCC2=CC=CC=C2

InChI

InChI=1S/C13H14NS/c1-14-10-6-5-9-13(14)15-11-12-7-3-2-4-8-12/h2-10H,11H2,1H3/q+1