6-chloranyl-N-[3-[(phenylmethyl)carbamoyl]phenyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-N-[3-[(phenylmethyl)carbamoyl]phenyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[3-(benzylcarbamoyl)phenyl]-6-chloro-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 6-chloro-N-[3-[oxo-[(phenylmethyl)amino]methyl]phenyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[3-(benzylcarbamoyl)phenyl]-6-chloro-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[3-(benzylcarbamoyl)phenyl]-6-chloro-2-(4-pyridyl)cinchoninamide Formula: C29H21ClN4O2 MolecularWeight: 492.95564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=NC=C5

InChI

InChI=1S/C29H21ClN4O2/c30-22-9-10-26-24(16-22)25(17-27(34-26)20-11-13-31-14-12-20)29(36)33-23-8-4-7-21(15-23)28(35)32-18-19-5-2-1-3-6-19/h1-17H,18H2,(H,32,35)(H,33,36)