N-phenyl-2-[4-(2-pyridin-4-ylquinolin-4-yl)carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-phenyl-2-[4-(2-pyridin-4-ylquinolin-4-yl)carbonylpiperazin-1-yl]ethanamide Openeye Name: N-phenyl-2-[4-[2-(4-pyridyl)quinoline-4-carbonyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]-1-piperazinyl]-N-phenylacetamide IUPAC Name: N-phenyl-2-[4-(2-pyridin-4-ylquinoline-4-carbonyl)piperazin-1-yl]acetamide Traditional Name: N-phenyl-2-[4-[2-(4-pyridyl)quinoline-4-carbonyl]piperazino]acetamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

InChI

InChI=1S/C27H25N5O2/c33-26(29-21-6-2-1-3-7-21)19-31-14-16-32(17-15-31)27(34)23-18-25(20-10-12-28-13-11-20)30-24-9-5-4-8-22(23)24/h1-13,18H,14-17,19H2,(H,29,33)