2-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methylsulfanyl]-1-butyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methylsulfanyl]-1-butyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[4-(difluoromethoxy)-3-methoxy-phenyl]methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[4-(difluoromethoxy)-3-methoxyphenyl]methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[4-(difluoromethoxy)-3-methoxyphenyl]methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[4-(difluoromethoxy)-3-methoxy-benzyl]thio]benzimidazole-5-sulfonamide Formula: C20H23F2N3O4S2 MolecularWeight: 471.541126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC(=C(C=C3)OC(F)F)OC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC(=C(C=C3)OC(F)F)OC

InChI

InChI=1S/C20H23F2N3O4S2/c1-3-4-9-25-16-7-6-14(31(23,26)27)11-15(16)24-20(25)30-12-13-5-8-17(29-19(21)22)18(10-13)28-2/h5-8,10-11,19H,3-4,9,12H2,1-2H3,(H2,23,26,27)