1-butyl-2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[2-oxo-2-(2-thienyl)ethyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[(2-oxo-2-thiophen-2-ylethyl)thio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-(2-oxo-2-thiophen-2-ylethyl)sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[2-keto-2-(2-thienyl)ethyl]thio]benzimidazole-5-sulfonamide Formula: C17H19N3O3S3 MolecularWeight: 409.54606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=CC=CS3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=CC=CS3

InChI

InChI=1S/C17H19N3O3S3/c1-2-3-8-20-14-7-6-12(26(18,22)23)10-13(14)19-17(20)25-11-15(21)16-5-4-9-24-16/h4-7,9-10H,2-3,8,11H2,1H3,(H2,18,22,23)