2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(m-tolyl)acetamide CAS Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]-N-(m-tolyl)acetamide Formula: C17H18N3OS+ MolecularWeight: 312.40932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=[NH+]C3=C(N2)C=C(C=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=[NH+]C3=C(N2)C=C(C=C3)C

InChI

InChI=1S/C17H17N3OS/c1-11-4-3-5-13(8-11)18-16(21)10-22-17-19-14-7-6-12(2)9-15(14)20-17/h3-9H,10H2,1-2H3,(H,18,21)(H,19,20)/p+1