N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]-3-piperidinecarboxamide IUPAC Name: N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-1-(2-thenoyl)nipecotamide Formula: C21H19F3N4O2S MolecularWeight: 448.46137

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=CC=N4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=CC=N4

InChI

InChI=1S/C21H19F3N4O2S/c22-21(23,24)15-6-7-17(28-10-3-8-25-28)16(12-15)26-19(29)14-4-1-9-27(13-14)20(30)18-5-2-11-31-18/h2-3,5-8,10-12,14H,1,4,9,13H2,(H,26,29)