1-(4-methylphenyl)sulfonyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]benzimidazole

Systemtic Name: 1-(4-methylphenyl)sulfonyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]benzimidazole Openeye Name: 1-(p-tolylsulfonyl)-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]benzimidazole CAS Name: 1-(4-methylphenyl)sulfonyl-2-[[4-(trifluoromethyl)phenyl]methylthio]benzimidazole IUPAC Name: 1-(4-methylphenyl)sulfonyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]benzimidazole Traditional Name: 1-tosyl-2-[[4-(trifluoromethyl)benzyl]thio]benzimidazole Formula: C22H17F3N2O2S2 MolecularWeight: 462.50779

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H17F3N2O2S2/c1-15-6-12-18(13-7-15)31(28,29)27-20-5-3-2-4-19(20)26-21(27)30-14-16-8-10-17(11-9-16)22(23,24)25/h2-13H,14H2,1H3