N-(4-ethanoylphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-acetylphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-(4-acetylphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-(4-acetylphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C18H18N3O3S+ MolecularWeight: 356.41882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O3S/c1-11(22)12-3-5-13(6-4-12)19-17(23)10-25-18-20-15-8-7-14(24-2)9-16(15)21-18/h3-9H,10H2,1-2H3,(H,19,23)(H,20,21)/p+1