1-ethyl-2-[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-2-[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[1-methyl-2-oxo-2-(p-tolyl)ethyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[[1-(4-methylphenyl)-1-oxopropan-2-yl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[1-(4-methylphenyl)-1-oxopropan-2-yl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[[2-keto-1-methyl-2-(p-tolyl)ethyl]thio]benzimidazole-5-sulfonamide Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H21N3O3S2/c1-4-22-17-10-9-15(27(20,24)25)11-16(17)21-19(22)26-13(3)18(23)14-7-5-12(2)6-8-14/h5-11,13H,4H2,1-3H3,(H2,20,24,25)