N-phenyl-4-[[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]carbonyl]piperidine-1-carboxamide

Systemtic Name: N-phenyl-4-[[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]carbonyl]piperidine-1-carboxamide Openeye Name: N-phenyl-4-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepane-1-carbonyl]piperidine-1-carboxamide CAS Name: 4-[oxo-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]methyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: N-phenyl-4-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane-1-carbonyl]piperidine-1-carboxamide Traditional Name: N-phenyl-4-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepane-1-carbonyl]piperidine-1-carboxamide Formula: C24H28F3N5O2 MolecularWeight: 475.50663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C24H28F3N5O2/c25-24(26,27)19-7-8-21(28-17-19)30-11-4-12-31(16-15-30)22(33)18-9-13-32(14-10-18)23(34)29-20-5-2-1-3-6-20/h1-3,5-8,17-18H,4,9-16H2,(H,29,34)