1-butyl-2-[2-(5-fluoranyl-2-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-N,N-dimethyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[2-(5-fluoranyl-2-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-N,N-dimethyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[2-(5-fluoro-2-methoxy-phenyl)-2-oxo-ethyl]sulfanyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl]thio]-N,N-dimethyl-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl]sulfanyl-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[2-(5-fluoro-2-methoxy-phenyl)-2-keto-ethyl]thio]-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C22H26FN3O4S2 MolecularWeight: 479.587943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C22H26FN3O4S2/c1-5-6-11-26-19-9-8-16(32(28,29)25(2)3)13-18(19)24-22(26)31-14-20(27)17-12-15(23)7-10-21(17)30-4/h7-10,12-13H,5-6,11,14H2,1-4H3