N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-2-(1,3,5-trimethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-2-(1,3,5-trimethylpyrazol-4-yl)cinchoninamide Formula: C29H23ClN4O2 MolecularWeight: 494.97152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=C(C=C4)Cl)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NN1C)C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=C(C=C4)Cl)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H23ClN4O2/c1-17-27(18(2)34(3)33-17)26-16-22(21-11-7-8-12-24(21)31-26)29(36)32-25-14-13-20(30)15-23(25)28(35)19-9-5-4-6-10-19/h4-16H,1-3H3,(H,32,36)