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

Systemtic Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]-N-(3-phenylpropyl)quinoline-4-carboxamide Openeye Name: 2-[1-(4-isopropylphenyl)-5-methyl-pyrazol-4-yl]-N-(3-phenylpropyl)quinoline-4-carboxamide CAS Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)-4-pyrazolyl]-N-(3-phenylpropyl)-4-quinolinecarboxamide IUPAC Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]-N-(3-phenylpropyl)quinoline-4-carboxamide Traditional Name: 2-(5-methyl-1-p-cumenyl-pyrazol-4-yl)-N-(3-phenylpropyl)cinchoninamide Formula: C32H32N4O MolecularWeight: 488.62268

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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)NCCCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)C(C)C)C3=NC4=CC=CC=C4C(=C3)C(=O)NCCCC5=CC=CC=C5

InChI

InChI=1S/C32H32N4O/c1-22(2)25-15-17-26(18-16-25)36-23(3)29(21-34-36)31-20-28(27-13-7-8-14-30(27)35-31)32(37)33-19-9-12-24-10-5-4-6-11-24/h4-8,10-11,13-18,20-22H,9,12,19H2,1-3H3,(H,33,37)