6-bromanyl-N-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[1-(2-fluorobenzyl)pyrazol-3-yl]-2-(4-pyridyl)cinchoninamide Formula: C25H17BrFN5O MolecularWeight: 502.337783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC(=N2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=NC=C5)F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC(=N2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=NC=C5)F

InChI

InChI=1S/C25H17BrFN5O/c26-18-5-6-22-19(13-18)20(14-23(29-22)16-7-10-28-11-8-16)25(33)30-24-9-12-32(31-24)15-17-3-1-2-4-21(17)27/h1-14H,15H2,(H,30,31,33)