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

Systemtic Name: 1-ethyl-2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]benzimidazole-5-sulfonamide Formula: C19H20FN3O3S2 MolecularWeight: 421.508803

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H20FN3O3S2/c1-2-23-17-10-9-15(28(21,25)26)12-16(17)22-19(23)27-11-3-4-18(24)13-5-7-14(20)8-6-13/h5-10,12H,2-4,11H2,1H3,(H2,21,25,26)