6-bromanyl-N-(4-morpholin-4-ylcarbonylphenyl)-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-(4-morpholin-4-ylcarbonylphenyl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[4-(morpholine-4-carbonyl)phenyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[4-[4-morpholinyl(oxo)methyl]phenyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[4-(morpholine-4-carbonyl)phenyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[4-(morpholine-4-carbonyl)phenyl]-2-(3-pyridyl)cinchoninamide Formula: C26H21BrN4O3 MolecularWeight: 517.37394

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CN=CC=C5

Isomeric SMILES

C1COCCN1C(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CN=CC=C5

InChI

InChI=1S/C26H21BrN4O3/c27-19-5-8-23-21(14-19)22(15-24(30-23)18-2-1-9-28-16-18)25(32)29-20-6-3-17(4-7-20)26(33)31-10-12-34-13-11-31/h1-9,14-16H,10-13H2,(H,29,32)