N-(2-ethyl-6-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[1-(4-fluorophenyl)-5-methyl-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-[1-(4-fluorophenyl)-5-methylpyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]cinchoninamide Formula: C29H25FN4O MolecularWeight: 464.533403

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C5=CC=C(C=C5)F)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C5=CC=C(C=C5)F)C)C

InChI

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