N-(2-pyridin-3-ylethyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-pyridin-3-ylethyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3-pyridyl)ethyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(3-pyridinyl)ethyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-pyridin-3-ylethyl)-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(3-pyridyl)ethyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C20H22F3N3O3S MolecularWeight: 441.46719

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H22F3N3O3S/c21-20(22,23)17-5-1-2-6-18(17)30(28,29)26-12-8-16(9-13-26)19(27)25-11-7-15-4-3-10-24-14-15/h1-6,10,14,16H,7-9,11-13H2,(H,25,27)