N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridine-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridine-3-carboxamide Openeye Name: N-isopentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide CAS Name: N-(3-methylbutyl)-6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide Traditional Name: N-isoamyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazino]nicotinamide Formula: C23H27F3N4O2 MolecularWeight: 448.48129

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC(C)CCNC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C23H27F3N4O2/c1-16(2)9-10-27-21(31)17-7-8-20(28-15-17)29-11-13-30(14-12-29)22(32)18-5-3-4-6-19(18)23(24,25)26/h3-8,15-16H,9-14H2,1-2H3,(H,27,31)