1-pyridin-3-ylsulfonyl-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]piperidine-4-carboxamide

Systemtic Name: 1-pyridin-3-ylsulfonyl-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]piperidine-4-carboxamide Openeye Name: 1-(3-pyridylsulfonyl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]piperidine-4-carboxamide CAS Name: 1-(3-pyridinylsulfonyl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-4-piperidinecarboxamide IUPAC Name: 1-pyridin-3-ylsulfonyl-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]piperidine-4-carboxamide Traditional Name: 1-(3-pyridylsulfonyl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]isonipecotamide Formula: C21H20F3N3O3S MolecularWeight: 451.46201

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC#CC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCC#CC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H20F3N3O3S/c22-21(23,24)18-6-1-4-16(14-18)5-2-11-26-20(28)17-8-12-27(13-9-17)31(29,30)19-7-3-10-25-15-19/h1,3-4,6-7,10,14-15,17H,8-9,11-13H2,(H,26,28)