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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-butyl-N-(1,1-dioxo-3-thiolanyl)-2-[(1-methyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-butyl-N-(1,1-diketothiolan-3-yl)-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C18H25N3O3S2/c1-3-4-10-21(14-9-11-26(23,24)13-14)17(22)12-25-18-19-15-7-5-6-8-16(15)20(18)2/h5-8,14H,3-4,9-13H2,1-2H3