2-(3-bromophenyl)-N-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: 2-(3-bromophenyl)-N-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 2-(3-bromophenyl)-N-(4-pyridyl)quinoline-4-carboxamide CAS Name: 2-(3-bromophenyl)-N-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: 2-(3-bromophenyl)-N-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 2-(3-bromophenyl)-N-(4-pyridyl)cinchoninamide Formula: C21H14BrN3O MolecularWeight: 404.25936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)NC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)NC4=CC=NC=C4

InChI

InChI=1S/C21H14BrN3O/c22-15-5-3-4-14(12-15)20-13-18(17-6-1-2-7-19(17)25-20)21(26)24-16-8-10-23-11-9-16/h1-13H,(H,23,24,26)