N-(1-cyanocyclopentyl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[(1-phenyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-(1-phenylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[(1-phenylbenzimidazol-2-yl)thio]acetamide Formula: C21H20N4OS MolecularWeight: 376.4747

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4

InChI

InChI=1S/C21H20N4OS/c22-15-21(12-6-7-13-21)24-19(26)14-27-20-23-17-10-4-5-11-18(17)25(20)16-8-2-1-3-9-16/h1-5,8-11H,6-7,12-14H2,(H,24,26)