2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(pyridin-4-ylmethylideneamino)ethanamide

Systemtic Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(pyridin-4-ylmethylideneamino)ethanamide Openeye Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(4-pyridylmethyleneamino)acetamide CAS Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]-N-(pyridin-4-ylmethylideneamino)acetamide IUPAC Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(pyridin-4-ylmethylideneamino)acetamide Traditional Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]-N-(4-pyridylmethyleneamino)acetamide Formula: C17H18N5OS+ MolecularWeight: 340.42272

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC3=CC=NC=C3

Isomeric SMILES

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC3=CC=NC=C3

InChI

InChI=1S/C17H17N5OS/c1-2-22-15-6-4-3-5-14(15)20-17(22)24-12-16(23)21-19-11-13-7-9-18-10-8-13/h3-11H,2,12H2,1H3,(H,18,21,23)/p+1