4-[(4-methylphenyl)sulfonylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide

Systemtic Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide Openeye Name: 4-(p-tolylsulfonylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide CAS Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide IUPAC Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide Traditional Name: 4-(tosylmethyl)-N-[3-(trifluoromethyl)benzyl]benzamide Formula: C23H20F3NO3S MolecularWeight: 447.47001

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C23H20F3NO3S/c1-16-5-11-21(12-6-16)31(29,30)15-17-7-9-19(10-8-17)22(28)27-14-18-3-2-4-20(13-18)23(24,25)26/h2-13H,14-15H2,1H3,(H,27,28)