2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]-N-(3-fluoranyl-4-methyl-phenyl)quinoline-4-carboxamide

Systemtic Name: 2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]-N-(3-fluoranyl-4-methyl-phenyl)quinoline-4-carboxamide Openeye Name: 2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]-N-(3-fluoro-4-methyl-phenyl)quinoline-4-carboxamide CAS Name: 2-[1-(4-ethylphenyl)-5-methyl-4-pyrazolyl]-N-(3-fluoro-4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: 2-[1-(4-ethylphenyl)-5-methylpyrazol-4-yl]-N-(3-fluoro-4-methylphenyl)quinoline-4-carboxamide Traditional Name: 2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]-N-(3-fluoro-4-methyl-phenyl)cinchoninamide Formula: C29H25FN4O MolecularWeight: 464.533403

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC(=C(C=C5)C)F)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC(=C(C=C5)C)F)C

InChI

InChI=1S/C29H25FN4O/c1-4-20-10-13-22(14-11-20)34-19(3)25(17-31-34)28-16-24(23-7-5-6-8-27(23)33-28)29(35)32-21-12-9-18(2)26(30)15-21/h5-17H,4H2,1-3H3,(H,32,35)