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

Systemtic Name: N-(2-adamantyl)-6-bromanyl-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-(2-adamantyl)-6-bromo-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-(2-adamantyl)-6-bromo-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-(2-adamantyl)-6-bromo-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-(2-adamantyl)-6-bromo-2-(4-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=CC=NC=C6

Isomeric SMILES

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

InChI

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