1-methyl-4-[2-(4-methylphenyl)sulfanylethyl]pyridin-1-ium

Systemtic Name: 1-methyl-4-[2-(4-methylphenyl)sulfanylethyl]pyridin-1-ium Openeye Name: 1-methyl-4-[2-(p-tolylsulfanyl)ethyl]pyridin-1-ium CAS Name: 1-methyl-4-[2-[(4-methylphenyl)thio]ethyl]pyridin-1-ium IUPAC Name: 1-methyl-4-[2-(4-methylphenyl)sulfanylethyl]pyridin-1-ium Traditional Name: 1-methyl-4-[2-(p-tolylthio)ethyl]pyridin-1-ium Formula: C15H18NS+ MolecularWeight: 244.37512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC2=CC=[N+](C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCC2=CC=[N+](C=C2)C

InChI

InChI=1S/C15H18NS/c1-13-3-5-15(6-4-13)17-12-9-14-7-10-16(2)11-8-14/h3-8,10-11H,9,12H2,1-2H3/q+1