1-butyl-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-(2-morpholino-2-oxo-ethyl)sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[(2-keto-2-morpholino-ethyl)thio]benzimidazole-5-sulfonamide Formula: C17H24N4O4S2 MolecularWeight: 412.52686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)N3CCOCC3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)N3CCOCC3

InChI

InChI=1S/C17H24N4O4S2/c1-2-3-6-21-15-5-4-13(27(18,23)24)11-14(15)19-17(21)26-12-16(22)20-7-9-25-10-8-20/h4-5,11H,2-3,6-10,12H2,1H3,(H2,18,23,24)