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

Systemtic Name: N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-2-(1-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(1-benzyl-4-chloropyrazol-3-yl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-2-(1-methylpyrazol-4-yl)cinchoninamide Formula: C24H19ClN6O MolecularWeight: 442.90026

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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=C4Cl)CC5=CC=CC=C5

Isomeric SMILES

CN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NN(C=C4Cl)CC5=CC=CC=C5

InChI

InChI=1S/C24H19ClN6O/c1-30-14-17(12-26-30)22-11-19(18-9-5-6-10-21(18)27-22)24(32)28-23-20(25)15-31(29-23)13-16-7-3-2-4-8-16/h2-12,14-15H,13H2,1H3,(H,28,29,32)