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

Systemtic Name: N-(2-adamantyl)-6-bromanyl-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(2-adamantyl)-6-bromo-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-(2-adamantyl)-6-bromo-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(2-adamantyl)-6-bromo-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(2-adamantyl)-6-bromo-2-(3-pyridyl)cinchoninamide Formula: C25H24BrN3O MolecularWeight: 462.38156

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC(=NC5=C4C=C(C=C5)Br)C6=CN=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC(=NC5=C4C=C(C=C5)Br)C6=CN=CC=C6

InChI

InChI=1S/C25H24BrN3O/c26-19-3-4-22-20(11-19)21(12-23(28-22)16-2-1-5-27-13-16)25(30)29-24-17-7-14-6-15(9-17)10-18(24)8-14/h1-5,11-15,17-18,24H,6-10H2,(H,29,30)