N-(3-ethanoylphenyl)-2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]quinoline-4-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(3-acetylphenyl)-2-[1-(4-isopropylphenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-(3-acetylphenyl)-2-[5-methyl-1-(4-propan-2-ylphenyl)-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(3-acetylphenyl)-2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-(3-acetylphenyl)-2-(5-methyl-1-p-cumenyl-pyrazol-4-yl)cinchoninamide Formula: C31H28N4O2 MolecularWeight: 488.57962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)C(C)C)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC=CC(=C5)C(=O)C

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)C(C)C)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC=CC(=C5)C(=O)C

InChI

InChI=1S/C31H28N4O2/c1-19(2)22-12-14-25(15-13-22)35-20(3)28(18-32-35)30-17-27(26-10-5-6-11-29(26)34-30)31(37)33-24-9-7-8-23(16-24)21(4)36/h5-19H,1-4H3,(H,33,37)