N-[3-(2-thiophen-2-ylethynyl)phenyl]-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-[3-(2-thiophen-2-ylethynyl)phenyl]-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Openeye Name: N-[3-[2-(2-thienyl)ethynyl]phenyl]-1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carboxamide CAS Name: N-[3-(2-thiophen-2-ylethynyl)phenyl]-1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(2-thiophen-2-ylethynyl)phenyl]-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Traditional Name: N-[3-[2-(2-thienyl)ethynyl]phenyl]-1-[5-(trifluoromethyl)-2-pyridyl]isonipecotamide Formula: C24H20F3N3OS MolecularWeight: 455.49531

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C24H20F3N3OS/c25-24(26,27)19-7-9-22(28-16-19)30-12-10-18(11-13-30)23(31)29-20-4-1-3-17(15-20)6-8-21-5-2-14-32-21/h1-5,7,9,14-16,18H,10-13H2,(H,29,31)