N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-(4-fluorophenyl)quinoline-4-carboxamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-(4-fluorophenyl)quinoline-4-carboxamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-(4-fluorophenyl)quinoline-4-carboxamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-2-(4-fluorophenyl)-4-quinolinecarboxamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]-2-(4-fluorophenyl)quinoline-4-carboxamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-(4-fluorophenyl)cinchoninamide Formula: C28H22FN5O MolecularWeight: 463.505583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H22FN5O/c1-18-25(19(2)34(33-18)22-8-4-3-5-9-22)17-30-32-28(35)24-16-27(20-12-14-21(29)15-13-20)31-26-11-7-6-10-23(24)26/h3-17H,1-2H3,(H,32,35)