N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[4-(2-ketopyrrolidino)benzyl]-2-(3-pyridyl)cinchoninamide Formula: C26H22N4O2 MolecularWeight: 422.47848

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C26H22N4O2/c31-25-8-4-14-30(25)20-11-9-18(10-12-20)16-28-26(32)22-15-24(19-5-3-13-27-17-19)29-23-7-2-1-6-21(22)23/h1-3,5-7,9-13,15,17H,4,8,14,16H2,(H,28,32)