5-(azepan-1-ylcarbonyl)-N-[2-(3-fluorophenyl)ethyl]-4-oxidanylidene-1-(oxolan-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-N-[2-(3-fluorophenyl)ethyl]-4-oxidanylidene-1-(oxolan-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-N-[2-(3-fluorophenyl)ethyl]-4-oxo-1-(tetrahydrofuran-2-ylmethyl)pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-N-[2-(3-fluorophenyl)ethyl]-4-oxo-1-(2-oxolanylmethyl)-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-N-[2-(3-fluorophenyl)ethyl]-4-oxo-1-(oxolan-2-ylmethyl)pyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-N-[2-(3-fluorophenyl)ethyl]-4-keto-1-(tetrahydrofurfuryl)nicotinamide Formula: C26H32FN3O4 MolecularWeight: 469.548383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CN(C=C(C2=O)C(=O)NCCC3=CC(=CC=C3)F)CC4CCCO4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CN(C=C(C2=O)C(=O)NCCC3=CC(=CC=C3)F)CC4CCCO4

InChI

InChI=1S/C26H32FN3O4/c27-20-8-5-7-19(15-20)10-11-28-25(32)22-17-29(16-21-9-6-14-34-21)18-23(24(22)31)26(33)30-12-3-1-2-4-13-30/h5,7-8,15,17-18,21H,1-4,6,9-14,16H2,(H,28,32)