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

Systemtic Name: N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridine-3-carboxamide Openeye Name: N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide CAS Name: 6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-N-(3-phenylpropyl)-3-pyridinecarboxamide IUPAC Name: N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide Traditional Name: N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazino]nicotinamide Formula: C27H27F3N4O2 MolecularWeight: 496.52409

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(=O)NCCCC3=CC=CC=C3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(=O)NCCCC3=CC=CC=C3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C27H27F3N4O2/c28-27(29,30)23-11-5-4-10-22(23)26(36)34-17-15-33(16-18-34)24-13-12-21(19-32-24)25(35)31-14-6-9-20-7-2-1-3-8-20/h1-5,7-8,10-13,19H,6,9,14-18H2,(H,31,35)