5-(azepan-1-ylcarbonyl)-N-[2-(1H-indol-3-yl)ethyl]-1-(2-methylpropyl)-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-N-[2-(1H-indol-3-yl)ethyl]-1-(2-methylpropyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-N-[2-(1H-indol-3-yl)ethyl]-1-isobutyl-4-oxo-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1-(2-methylpropyl)-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-N-[2-(1H-indol-3-yl)ethyl]-1-(2-methylpropyl)-4-oxopyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-N-[2-(1H-indol-3-yl)ethyl]-1-isobutyl-4-keto-nicotinamide Formula: C27H34N4O3 MolecularWeight: 462.58386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C27H34N4O3/c1-19(2)16-30-17-22(25(32)23(18-30)27(34)31-13-7-3-4-8-14-31)26(33)28-12-11-20-15-29-24-10-6-5-9-21(20)24/h5-6,9-10,15,17-19,29H,3-4,7-8,11-14,16H2,1-2H3,(H,28,33)