N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-2-oxidanylidene-3-pyridin-2-yl-propanamide

Systemtic Name: N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-2-oxidanylidene-3-pyridin-2-yl-propanamide Openeye Name: N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-2-oxo-3-(2-pyridyl)propanamide CAS Name: N-[3-[4-methyl-1-(4-phenyl-1-piperazinyl)cyclohexyl]phenyl]-2-oxo-3-(2-pyridinyl)propanamide IUPAC Name: N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-2-oxo-3-pyridin-2-ylpropanamide Traditional Name: 2-keto-N-[3-[4-methyl-1-(4-phenylpiperazino)cyclohexyl]phenyl]-3-(2-pyridyl)propionamide Formula: C31H36N4O2 MolecularWeight: 496.64314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C(=O)CC3=CC=CC=N3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C(=O)CC3=CC=CC=N3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C31H36N4O2/c1-24-13-15-31(16-14-24,35-20-18-34(19-21-35)28-11-3-2-4-12-28)25-8-7-10-27(22-25)33-30(37)29(36)23-26-9-5-6-17-32-26/h2-12,17,22,24H,13-16,18-21,23H2,1H3,(H,33,37)