2-[2-(2,5-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[2-(2,5-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[2-(2,5-dimethoxyphenyl)-2-oxo-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[2-(2,5-dimethoxyphenyl)-2-oxoethyl]thio]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[2-(2,5-dimethoxyphenyl)-2-keto-ethyl]thio]-1-ethyl-benzimidazole-5-sulfonamide Formula: C19H21N3O5S2 MolecularWeight: 435.51714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O5S2/c1-4-22-16-7-6-13(29(20,24)25)10-15(16)21-19(22)28-11-17(23)14-9-12(26-2)5-8-18(14)27-3/h5-10H,4,11H2,1-3H3,(H2,20,24,25)