2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(3-methyl-4-oxidanyl-phenyl)ethanamide

Systemtic Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(3-methyl-4-oxidanyl-phenyl)ethanamide Openeye Name: N-(4-hydroxy-3-methyl-phenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-(4-hydroxy-3-methylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-(4-hydroxy-3-methylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-(4-hydroxy-3-methyl-phenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C17H18N3O2S+ MolecularWeight: 328.40872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C)O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C)O

InChI

InChI=1S/C17H17N3O2S/c1-11-9-12(7-8-15(11)21)18-16(22)10-23-17-19-13-5-3-4-6-14(13)20(17)2/h3-9H,10H2,1-2H3,(H2,18,21,22)/p+1