2-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[2-(4-ethoxyphenyl)-2-oxo-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[2-(4-ethoxyphenyl)-2-oxoethyl]thio]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[(2-keto-2-p-phenetyl-ethyl)thio]benzimidazole-5-sulfonamide Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C19H21N3O4S2/c1-3-22-17-10-9-15(28(20,24)25)11-16(17)21-19(22)27-12-18(23)13-5-7-14(8-6-13)26-4-2/h5-11H,3-4,12H2,1-2H3,(H2,20,24,25)