N,N-diethyl-1-propan-2-yl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: N,N-diethyl-1-propan-2-yl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: N,N-diethyl-1-isopropyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: N,N-diethyl-1-propan-2-yl-2-[[3-(trifluoromethyl)phenyl]methylthio]-5-benzimidazolesulfonamide IUPAC Name: N,N-diethyl-1-propan-2-yl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: N,N-diethyl-1-isopropyl-2-[[3-(trifluoromethyl)benzyl]thio]benzimidazole-5-sulfonamide Formula: C22H26F3N3O2S2 MolecularWeight: 485.58595

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC(=CC=C3)C(F)(F)F)C(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC(=CC=C3)C(F)(F)F)C(C)C

InChI

InChI=1S/C22H26F3N3O2S2/c1-5-27(6-2)32(29,30)18-10-11-20-19(13-18)26-21(28(20)15(3)4)31-14-16-8-7-9-17(12-16)22(23,24)25/h7-13,15H,5-6,14H2,1-4H3