2-[1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[1-(2,5-dimethylphenyl)-1-oxopropan-2-yl]thio]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[1-(2,5-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl]thio]-1-ethyl-benzimidazole-5-sulfonamide Formula: C20H23N3O3S2 MolecularWeight: 417.54492

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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=C(C=CC(=C3)C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O3S2/c1-5-23-18-9-8-15(28(21,25)26)11-17(18)22-20(23)27-14(4)19(24)16-10-12(2)6-7-13(16)3/h6-11,14H,5H2,1-4H3,(H2,21,25,26)