2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N,N-diphenyl-ethanamide

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N,N-diphenyl-ethanamide Openeye Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N,N-diphenyl-acetamide CAS Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N,N-diphenylacetamide IUPAC Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N,N-diphenylacetamide Traditional Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N,N-diphenyl-acetamide Formula: C21H18N3OS+ MolecularWeight: 360.45212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)CSC3=[NH+]C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)CSC3=[NH+]C4=CC=CC=C4N3

InChI

InChI=1S/C21H17N3OS/c25-20(15-26-21-22-18-13-7-8-14-19(18)23-21)24(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14H,15H2,(H,22,23)/p+1