N-(5-propyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Openeye Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carboxamide CAS Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Traditional Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)-2-pyridyl]isonipecotamide Formula: C17H20F3N5OS MolecularWeight: 399.43381

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H20F3N5OS/c1-2-3-14-23-24-16(27-14)22-15(26)11-6-8-25(9-7-11)13-5-4-12(10-21-13)17(18,19)20/h4-5,10-11H,2-3,6-9H2,1H3,(H,22,24,26)