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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-butyl-N-(1,1-dioxo-3-thiolanyl)-2-[(1-phenethyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(1-phenethylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-butyl-N-(1,1-diketothiolan-3-yl)-2-[(1-phenethylbenzimidazol-2-yl)thio]acetamide Formula: C25H31N3O3S2 MolecularWeight: 485.66194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4

Isomeric SMILES

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O3S2/c1-2-3-15-27(21-14-17-33(30,31)19-21)24(29)18-32-25-26-22-11-7-8-12-23(22)28(25)16-13-20-9-5-4-6-10-20/h4-12,21H,2-3,13-19H2,1H3