N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(1-hexylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(1-hexylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-(1-hexylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-[(1-hexyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-(1-hexylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-[(1-hexylbenzimidazol-2-yl)thio]acetamide Formula: C19H27N3O3S2 MolecularWeight: 409.56598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC3CCS(=O)(=O)C3

InChI

InChI=1S/C19H27N3O3S2/c1-2-3-4-7-11-22-17-9-6-5-8-16(17)21-19(22)26-13-18(23)20-15-10-12-27(24,25)14-15/h5-6,8-9,15H,2-4,7,10-14H2,1H3,(H,20,23)