6-bromanyl-N-[(2-fluorophenyl)methyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[(2-fluorophenyl)methyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[(2-fluorophenyl)methyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[(2-fluorophenyl)methyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[(2-fluorophenyl)methyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-(2-fluorobenzyl)-2-(4-pyridyl)cinchoninamide Formula: C22H15BrFN3O MolecularWeight: 436.276403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=NC=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=NC=C4)F

InChI

InChI=1S/C22H15BrFN3O/c23-16-5-6-20-17(11-16)18(12-21(27-20)14-7-9-25-10-8-14)22(28)26-13-15-3-1-2-4-19(15)24/h1-12H,13H2,(H,26,28)