2-pyridin-4-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-pyridin-4-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-(4-pyridyl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)quinoline-4-carboxamide CAS Name: 2-pyridin-4-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-pyridin-4-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-(4-pyridyl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)cinchoninamide Formula: C22H16N6O MolecularWeight: 380.40204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NCC4=NN=C5N4C=CC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NCC4=NN=C5N4C=CC=C5

InChI

InChI=1S/C22H16N6O/c29-22(24-14-21-27-26-20-7-3-4-12-28(20)21)17-13-19(15-8-10-23-11-9-15)25-18-6-2-1-5-16(17)18/h1-13H,14H2,(H,24,29)