5-(azocan-1-ylcarbonyl)-N-[(4-methylphenyl)methyl]-4-oxidanylidene-1-(2-pyridin-2-ylethyl)pyridine-3-carboxamide

Systemtic Name: 5-(azocan-1-ylcarbonyl)-N-[(4-methylphenyl)methyl]-4-oxidanylidene-1-(2-pyridin-2-ylethyl)pyridine-3-carboxamide Openeye Name: 5-(azocane-1-carbonyl)-4-oxo-N-(p-tolylmethyl)-1-[2-(2-pyridyl)ethyl]pyridine-3-carboxamide CAS Name: 5-[1-azocanyl(oxo)methyl]-N-[(4-methylphenyl)methyl]-4-oxo-1-[2-(2-pyridinyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 5-(azocane-1-carbonyl)-N-[(4-methylphenyl)methyl]-4-oxo-1-(2-pyridin-2-ylethyl)pyridine-3-carboxamide Traditional Name: 5-(azocane-1-carbonyl)-4-keto-N-(4-methylbenzyl)-1-[2-(2-pyridyl)ethyl]nicotinamide Formula: C29H34N4O3 MolecularWeight: 486.60526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CN(C=C(C2=O)C(=O)N3CCCCCCC3)CCC4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CN(C=C(C2=O)C(=O)N3CCCCCCC3)CCC4=CC=CC=N4

InChI

InChI=1S/C29H34N4O3/c1-22-10-12-23(13-11-22)19-31-28(35)25-20-32(18-14-24-9-5-6-15-30-24)21-26(27(25)34)29(36)33-16-7-3-2-4-8-17-33/h5-6,9-13,15,20-21H,2-4,7-8,14,16-19H2,1H3,(H,31,35)