N-(4-bromanyl-2-fluoranyl-phenyl)-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-(4-pyridyl)cinchoninamide Formula: C21H13BrFN3O MolecularWeight: 422.249823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13BrFN3O/c22-14-5-6-19(17(23)11-14)26-21(27)16-12-20(13-7-9-24-10-8-13)25-18-4-2-1-3-15(16)18/h1-12H,(H,26,27)