4-methylsulfanyl-1-(phenylmethyl)quinolin-1-ium chloride

Systemtic Name: 4-methylsulfanyl-1-(phenylmethyl)quinolin-1-ium chloride Openeye Name: 1-benzyl-4-methylsulfanyl-quinolin-1-ium chloride CAS Name: 4-(methylthio)-1-(phenylmethyl)quinolin-1-ium chloride IUPAC Name: 1-benzyl-4-methylsulfanylquinolin-1-ium chloride Traditional Name: 1-benzyl-4-(methylthio)quinolin-1-ium chloride Formula: C17H16ClNS MolecularWeight: 301.83364

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=[N+](C2=CC=CC=C21)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

CSC1=CC=[N+](C2=CC=CC=C21)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C17H16NS.ClH/c1-19-17-11-12-18(13-14-7-3-2-4-8-14)16-10-6-5-9-15(16)17;/h2-12H,13H2,1H3;1H/q+1;/p-1