5-[2-(4-fluorophenyl)sulfanylethyl]-2-methyl-pyridin-1-ium

Systemtic Name: 5-[2-(4-fluorophenyl)sulfanylethyl]-2-methyl-pyridin-1-ium Openeye Name: 5-[2-(4-fluorophenyl)sulfanylethyl]-2-methyl-pyridin-1-ium CAS Name: 5-[2-[(4-fluorophenyl)thio]ethyl]-2-methylpyridin-1-ium IUPAC Name: 5-[2-(4-fluorophenyl)sulfanylethyl]-2-methylpyridin-1-ium Traditional Name: 5-[2-[(4-fluorophenyl)thio]ethyl]-2-methyl-pyridin-1-ium Formula: C14H15FNS+ MolecularWeight: 248.339003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C=C(C=C1)CCSC2=CC=C(C=C2)F

Isomeric SMILES

CC1=[NH+]C=C(C=C1)CCSC2=CC=C(C=C2)F

InChI

InChI=1S/C14H14FNS/c1-11-2-3-12(10-16-11)8-9-17-14-6-4-13(15)5-7-14/h2-7,10H,8-9H2,1H3/p+1