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

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-(2-chloro-4-fluorophenyl)-2-[1-(4-ethylphenyl)-5-methyl-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-2-[1-(4-ethylphenyl)-5-methylpyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]cinchoninamide Formula: C28H22ClFN4O MolecularWeight: 484.951883

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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=C(C=C(C=C5)F)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C28H22ClFN4O/c1-3-18-8-11-20(12-9-18)34-17(2)23(16-31-34)27-15-22(21-6-4-5-7-25(21)32-27)28(35)33-26-13-10-19(30)14-24(26)29/h4-16H,3H2,1-2H3,(H,33,35)