6,8-dimethyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: 6,8-dimethyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: 6,8-dimethyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: 6,8-dimethyl-N-[3-(1-pyrazolylmethyl)phenyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6,8-dimethyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: 6,8-dimethyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-2-(2-pyridyl)cinchoninamide Formula: C27H23N5O MolecularWeight: 433.50442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=N3)C(=O)NC4=CC=CC(=C4)CN5C=CC=N5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=N3)C(=O)NC4=CC=CC(=C4)CN5C=CC=N5)C

InChI

InChI=1S/C27H23N5O/c1-18-13-19(2)26-22(14-18)23(16-25(31-26)24-9-3-4-10-28-24)27(33)30-21-8-5-7-20(15-21)17-32-12-6-11-29-32/h3-16H,17H2,1-2H3,(H,30,33)