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

Systemtic Name: 2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]-N-(3-fluorophenyl)quinoline-4-carboxamide Openeye Name: 2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]-N-(3-fluorophenyl)quinoline-4-carboxamide CAS Name: 2-[1-(4-ethylphenyl)-5-methyl-4-pyrazolyl]-N-(3-fluorophenyl)-4-quinolinecarboxamide IUPAC Name: 2-[1-(4-ethylphenyl)-5-methylpyrazol-4-yl]-N-(3-fluorophenyl)quinoline-4-carboxamide Traditional Name: 2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]-N-(3-fluorophenyl)cinchoninamide Formula: C28H23FN4O MolecularWeight: 450.506823

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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(=CC=C5)F)C

Isomeric SMILES

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

InChI

InChI=1S/C28H23FN4O/c1-3-19-11-13-22(14-12-19)33-18(2)25(17-30-33)27-16-24(23-9-4-5-10-26(23)32-27)28(34)31-21-8-6-7-20(29)15-21/h4-17H,3H2,1-2H3,(H,31,34)