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

Systemtic Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]-N-(1-phenylethyl)quinoline-4-carboxamide Openeye Name: 2-[1-(4-isopropylphenyl)-5-methyl-pyrazol-4-yl]-N-(1-phenylethyl)quinoline-4-carboxamide CAS Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)-4-pyrazolyl]-N-(1-phenylethyl)-4-quinolinecarboxamide IUPAC Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]-N-(1-phenylethyl)quinoline-4-carboxamide Traditional Name: 2-(5-methyl-1-p-cumenyl-pyrazol-4-yl)-N-(1-phenylethyl)cinchoninamide Formula: C31H30N4O MolecularWeight: 474.5961

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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)NC(C)C5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C31H30N4O/c1-20(2)23-14-16-25(17-15-23)35-22(4)28(19-32-35)30-18-27(26-12-8-9-13-29(26)34-30)31(36)33-21(3)24-10-6-5-7-11-24/h5-21H,1-4H3,(H,33,36)