2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]-N-(1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]-N-(1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]thio]-N-(1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)thio]-N-(1,3,4-thiadiazol-2-yl)acetamide Formula: C18H16N5OS2+ MolecularWeight: 382.48254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)NC4=NN=CS4

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)NC4=NN=CS4

InChI

InChI=1S/C18H15N5OS2/c24-16(21-17-22-19-12-26-17)11-25-18-20-14-8-4-5-9-15(14)23(18)10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,22,24)/p+1