N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-2-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: N-[1-ethyl-3-[oxo-(phenethylamino)methyl]-4-pyrazolyl]-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-2-(p-tolyl)cinchoninamide Formula: C31H29N5O2 MolecularWeight: 503.59426

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCCC2=CC=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCCC2=CC=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C

InChI

InChI=1S/C31H29N5O2/c1-3-36-20-28(29(35-36)31(38)32-18-17-22-9-5-4-6-10-22)34-30(37)25-19-27(23-15-13-21(2)14-16-23)33-26-12-8-7-11-24(25)26/h4-16,19-20H,3,17-18H2,1-2H3,(H,32,38)(H,34,37)