N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]pyridine-3-carboxamide

Systemtic Name: N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]pyridine-3-carboxamide Openeye Name: N-[[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]carbamothioyl]pyridine-3-carboxamide CAS Name: N-[[2-(1-piperidinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]pyridine-3-carboxamide Traditional Name: N-[[2-piperidino-5-(trifluoromethyl)phenyl]thiocarbamoyl]nicotinamide Formula: C19H19F3N4OS MolecularWeight: 408.44057

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C3=CN=CC=C3

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H19F3N4OS/c20-19(21,22)14-6-7-16(26-9-2-1-3-10-26)15(11-14)24-18(28)25-17(27)13-5-4-8-23-12-13/h4-8,11-12H,1-3,9-10H2,(H2,24,25,27,28)