N-[2-[1-[(6-fluoranylquinolin-2-yl)methyl]piperidin-4-yl]pyrazol-3-yl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[1-[(6-fluoranylquinolin-2-yl)methyl]piperidin-4-yl]pyrazol-3-yl]-2-phenyl-ethanamide Openeye Name: N-[2-[1-[(6-fluoro-2-quinolyl)methyl]-4-piperidyl]pyrazol-3-yl]-2-phenyl-acetamide CAS Name: N-[2-[1-[(6-fluoro-2-quinolinyl)methyl]-4-piperidinyl]-3-pyrazolyl]-2-phenylacetamide IUPAC Name: N-[2-[1-[(6-fluoroquinolin-2-yl)methyl]piperidin-4-yl]pyrazol-3-yl]-2-phenylacetamide Traditional Name: N-[2-[1-[(6-fluoro-2-quinolyl)methyl]-4-piperidyl]pyrazol-3-yl]-2-phenyl-acetamide Formula: C26H26FN5O MolecularWeight: 443.515943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=CC=N2)NC(=O)CC3=CC=CC=C3)CC4=NC5=C(C=C4)C=C(C=C5)F

Isomeric SMILES

C1CN(CCC1N2C(=CC=N2)NC(=O)CC3=CC=CC=C3)CC4=NC5=C(C=C4)C=C(C=C5)F

InChI

InChI=1S/C26H26FN5O/c27-21-7-9-24-20(17-21)6-8-22(29-24)18-31-14-11-23(12-15-31)32-25(10-13-28-32)30-26(33)16-19-4-2-1-3-5-19/h1-10,13,17,23H,11-12,14-16,18H2,(H,30,33)