N-[(4-chlorophenyl)methyl]-2-(1-hexylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-(1-hexylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-(1-hexylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[(1-hexyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-(1-hexylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4-chlorobenzyl)-2-[(1-hexylbenzimidazol-2-yl)thio]acetamide Formula: C22H26ClN3OS MolecularWeight: 415.97934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H26ClN3OS/c1-2-3-4-7-14-26-20-9-6-5-8-19(20)25-22(26)28-16-21(27)24-15-17-10-12-18(23)13-11-17/h5-6,8-13H,2-4,7,14-16H2,1H3,(H,24,27)