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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C(=O)CC3=CN=CC=C3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C(=O)CC3=CN=CC=C3)N4CCN(CC4)C5=CC=CC=C5

InChI

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