N-(3-aminocarbonyl-2-methyl-phenyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-2-methyl-phenyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-carbamoyl-2-methyl-phenyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-carbamoyl-2-methylphenyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-carbamoyl-2-methylphenyl)-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-carbamoyl-2-methyl-phenyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C21H22F3N3O4S MolecularWeight: 469.47729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)C(=O)N

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)C(=O)N

InChI

InChI=1S/C21H22F3N3O4S/c1-13-15(19(25)28)5-4-7-17(13)26-20(29)14-9-11-27(12-10-14)32(30,31)18-8-3-2-6-16(18)21(22,23)24/h2-8,14H,9-12H2,1H3,(H2,25,28)(H,26,29)