6-(2-methylsulfonylphenyl)-2-[[4-(trifluoromethyl)phenoxy]methyl]-1H-benzimidazole

Systemtic Name: 6-(2-methylsulfonylphenyl)-2-[[4-(trifluoromethyl)phenoxy]methyl]-1H-benzimidazole Openeye Name: 6-(2-methylsulfonylphenyl)-2-[[4-(trifluoromethyl)phenoxy]methyl]-1H-benzimidazole CAS Name: 6-(2-methylsulfonylphenyl)-2-[[4-(trifluoromethyl)phenoxy]methyl]-1H-benzimidazole IUPAC Name: 6-(2-methylsulfonylphenyl)-2-[[4-(trifluoromethyl)phenoxy]methyl]-1H-benzimidazole Traditional Name: 6-(2-mesylphenyl)-2-[[4-(trifluoromethyl)phenoxy]methyl]-1H-benzimidazole Formula: C22H17F3N2O3S MolecularWeight: 446.44219

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC3=C(C=C2)N=C(N3)COC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC3=C(C=C2)N=C(N3)COC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H17F3N2O3S/c1-31(28,29)20-5-3-2-4-17(20)14-6-11-18-19(12-14)27-21(26-18)13-30-16-9-7-15(8-10-16)22(23,24)25/h2-12H,13H2,1H3,(H,26,27)