N-(2-methyl-5-methylsulfonyl-phenyl)-1-[4-(trifluoromethyl)phenyl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-5-methylsulfonyl-phenyl)-1-[4-(trifluoromethyl)phenyl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-5-methylsulfonyl-phenyl)-1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxamide CAS Name: N-(2-methyl-5-methylsulfonylphenyl)-1-[oxo-[4-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-5-methylsulfonylphenyl)-1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxamide Traditional Name: N-(5-mesyl-2-methyl-phenyl)-1-[4-(trifluoromethyl)benzoyl]isonipecotamide Formula: C22H23F3N2O4S MolecularWeight: 468.48923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H23F3N2O4S/c1-14-3-8-18(32(2,30)31)13-19(14)26-20(28)15-9-11-27(12-10-15)21(29)16-4-6-17(7-5-16)22(23,24)25/h3-8,13,15H,9-12H2,1-2H3,(H,26,28)