4-[2-(4-propan-2-ylphenyl)sulfanylethyl]pyridin-1-ium

Systemtic Name: 4-[2-(4-propan-2-ylphenyl)sulfanylethyl]pyridin-1-ium Openeye Name: 4-[2-(4-isopropylphenyl)sulfanylethyl]pyridin-1-ium CAS Name: 4-[2-[(4-propan-2-ylphenyl)thio]ethyl]pyridin-1-ium IUPAC Name: 4-[2-(4-propan-2-ylphenyl)sulfanylethyl]pyridin-1-ium Traditional Name: 4-[2-(p-cumenylthio)ethyl]pyridin-1-ium Formula: C16H20NS+ MolecularWeight: 258.4017

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SCCC2=CC=[NH+]C=C2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SCCC2=CC=[NH+]C=C2

InChI

InChI=1S/C16H19NS/c1-13(2)15-3-5-16(6-4-15)18-12-9-14-7-10-17-11-8-14/h3-8,10-11,13H,9,12H2,1-2H3/p+1