2-[(2-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazol-3-ium

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazol-3-ium Openeye Name: 2-[(2-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazol-3-ium CAS Name: 2-[[(2-chlorophenyl)methylthio]methyl]-1H-benzimidazol-3-ium IUPAC Name: 2-[(2-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazol-3-ium Traditional Name: 2-[[(2-chlorobenzyl)thio]methyl]-1H-benzimidazol-3-ium Formula: C15H14ClN2S+ MolecularWeight: 289.80306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC2=[NH+]C3=CC=CC=C3N2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSCC2=[NH+]C3=CC=CC=C3N2)Cl

InChI

InChI=1S/C15H13ClN2S/c16-12-6-2-1-5-11(12)9-19-10-15-17-13-7-3-4-8-14(13)18-15/h1-8H,9-10H2,(H,17,18)/p+1