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

Systemtic Name: 6-chloranyl-N-[2-(phenylmethyl)phenyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-(2-benzylphenyl)-6-chloro-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 6-chloro-N-[2-(phenylmethyl)phenyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-(2-benzylphenyl)-6-chloro-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-(2-benzylphenyl)-6-chloro-2-(4-pyridyl)cinchoninamide Formula: C28H20ClN3O MolecularWeight: 449.9309

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=NC=C5

InChI

InChI=1S/C28H20ClN3O/c29-22-10-11-26-23(17-22)24(18-27(31-26)20-12-14-30-15-13-20)28(33)32-25-9-5-4-8-21(25)16-19-6-2-1-3-7-19/h1-15,17-18H,16H2,(H,32,33)