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

Systemtic Name: N-(4-ethoxyphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-(4-ethoxyphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: 2-[(6-methoxy-1H-benzimidazol-3-ium-2-yl)thio]-N-p-phenetyl-acetamide Formula: C18H20N3O3S+ MolecularWeight: 358.4347

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=[NH+]C3=C(N2)C=C(C=C3)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=[NH+]C3=C(N2)C=C(C=C3)OC

InChI

InChI=1S/C18H19N3O3S/c1-3-24-13-6-4-12(5-7-13)19-17(22)11-25-18-20-15-9-8-14(23-2)10-16(15)21-18/h4-10H,3,11H2,1-2H3,(H,19,22)(H,20,21)/p+1