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

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-(3-pyridyl)cinchoninamide Formula: C27H22N6O MolecularWeight: 446.50318

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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=CN=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C27H22N6O/c1-18-24(19(2)33(32-18)21-10-4-3-5-11-21)17-29-31-27(34)23-15-26(20-9-8-14-28-16-20)30-25-13-7-6-12-22(23)25/h3-17H,1-2H3,(H,31,34)