(4-methoxyphenyl)-[2-(phenylmethylsulfanyl)pyridin-1-ium-1-yl]azanide

Systemtic Name: (4-methoxyphenyl)-[2-(phenylmethylsulfanyl)pyridin-1-ium-1-yl]azanide Openeye Name: (2-benzylsulfanylpyridin-1-ium-1-yl)-(4-methoxyphenyl)azanide CAS Name: (4-methoxyphenyl)-[2-(phenylmethylthio)-1-pyridin-1-iumyl]azanide IUPAC Name: (2-benzylsulfanylpyridin-1-ium-1-yl)-(4-methoxyphenyl)azanide Traditional Name: [2-(benzylthio)pyridin-1-ium-1-yl]-(4-methoxyphenyl)azanide Formula: C19H18N2OS MolecularWeight: 322.42402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[N-][N+]2=CC=CC=C2SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)[N-][N+]2=CC=CC=C2SCC3=CC=CC=C3

InChI

InChI=1S/C19H18N2OS/c1-22-18-12-10-17(11-13-18)20-21-14-6-5-9-19(21)23-15-16-7-3-2-4-8-16/h2-14H,15H2,1H3