2-(1H-benzimidazol-2-ylsulfanyl)-N-(3-imidazol-1-ylpropyl)ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(3-imidazol-1-ylpropyl)ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-(3-imidazol-1-ylpropyl)acetamide Formula: C15H17N5OS MolecularWeight: 315.39338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC(=O)NCCCN3C=CN=C3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C15H17N5OS/c21-14(17-6-3-8-20-9-7-16-11-20)10-22-15-18-12-4-1-2-5-13(12)19-15/h1-2,4-5,7,9,11H,3,6,8,10H2,(H,17,21)(H,18,19)