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

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-3-pyrazolyl]-2-(1-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)cinchoninamide Formula: C24H18ClFN6O MolecularWeight: 460.890723

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NN(C=C4)CC5=C(C=C(C=C5)F)Cl

Isomeric SMILES

CN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NN(C=C4)CC5=C(C=C(C=C5)F)Cl

InChI

InChI=1S/C24H18ClFN6O/c1-31-13-16(12-27-31)22-11-19(18-4-2-3-5-21(18)28-22)24(33)29-23-8-9-32(30-23)14-15-6-7-17(26)10-20(15)25/h2-13H,14H2,1H3,(H,29,30,33)