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

Systemtic Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Openeye Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carboxamide CAS Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Traditional Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-[5-(trifluoromethyl)-2-pyridyl]isonipecotamide Formula: C18H22F3N5OS MolecularWeight: 413.46039

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H22F3N5OS/c1-2-3-4-15-24-25-17(28-15)23-16(27)12-7-9-26(10-8-12)14-6-5-13(11-22-14)18(19,20)21/h5-6,11-12H,2-4,7-10H2,1H3,(H,23,25,27)