2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(4-ethoxyphenyl)ethanamide

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(4-ethoxyphenyl)ethanamide Openeye Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(4-ethoxyphenyl)acetamide CAS Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-(4-ethoxyphenyl)acetamide IUPAC Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(4-ethoxyphenyl)acetamide Traditional Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-p-phenetyl-acetamide Formula: C17H18N3O2S+ MolecularWeight: 328.40872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=[NH+]C3=CC=CC=C3N2

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=[NH+]C3=CC=CC=C3N2

InChI

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