1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(3-cyanothiophen-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(3-cyanothiophen-2-yl)piperidine-4-carboxamide Openeye Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(3-cyano-2-thienyl)piperidine-4-carboxamide CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(3-cyano-2-thiophenyl)-4-piperidinecarboxamide IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(3-cyanothiophen-2-yl)piperidine-4-carboxamide Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(3-cyano-2-thienyl)isonipecotamide Formula: C17H14ClF3N4OS MolecularWeight: 414.83247

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CS2)C#N)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CS2)C#N)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C17H14ClF3N4OS/c18-13-7-12(17(19,20)21)9-23-14(13)25-4-1-10(2-5-25)15(26)24-16-11(8-22)3-6-27-16/h3,6-7,9-10H,1-2,4-5H2,(H,24,26)