N-quinolin-5-yl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]propanamide

Systemtic Name: N-quinolin-5-yl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]propanamide Openeye Name: N-(5-quinolyl)-2-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]propanamide CAS Name: N-(5-quinolinyl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]propanamide IUPAC Name: N-quinolin-5-yl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]propanamide Traditional Name: N-(5-quinolyl)-2-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]propionamide Formula: C23H24F3N5O MolecularWeight: 443.46477

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)N3CCCN(CC3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)N3CCCN(CC3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H24F3N5O/c1-16(22(32)29-20-7-2-6-19-18(20)5-3-10-27-19)30-11-4-12-31(14-13-30)21-9-8-17(15-28-21)23(24,25)26/h2-3,5-10,15-16H,4,11-14H2,1H3,(H,29,32)