N-(1H-benzimidazol-3-ium-2-ylmethyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-(1H-benzimidazol-3-ium-2-ylmethyl)-4-methyl-benzenesulfonamide Openeye Name: N-(1H-benzimidazol-3-ium-2-ylmethyl)-4-methyl-benzenesulfonamide CAS Name: N-(1H-benzimidazol-3-ium-2-ylmethyl)-4-methylbenzenesulfonamide IUPAC Name: N-(1H-benzimidazol-3-ium-2-ylmethyl)-4-methylbenzenesulfonamide Traditional Name: N-(1H-benzimidazol-3-ium-2-ylmethyl)-4-methyl-benzenesulfonamide Formula: C15H16N3O2S+ MolecularWeight: 302.37144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2=[NH+]C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2=[NH+]C3=CC=CC=C3N2

InChI

InChI=1S/C15H15N3O2S/c1-11-6-8-12(9-7-11)21(19,20)16-10-15-17-13-4-2-3-5-14(13)18-15/h2-9,16H,10H2,1H3,(H,17,18)/p+1