N-quinolin-3-yl-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-quinolin-3-yl-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-quinolyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-quinolinyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-quinolin-3-yl-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-quinolyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C22H20F3N3O3S MolecularWeight: 463.47271

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=CC=CC=C3N=C2)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=CC=CC=C3N=C2)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H20F3N3O3S/c23-22(24,25)17-5-3-6-19(13-17)32(30,31)28-10-8-15(9-11-28)21(29)27-18-12-16-4-1-2-7-20(16)26-14-18/h1-7,12-15H,8-11H2,(H,27,29)