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

Systemtic Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]-N-propyl-quinoline-4-carboxamide Openeye Name: 2-[1-(4-isopropylphenyl)-5-methyl-pyrazol-4-yl]-N-propyl-quinoline-4-carboxamide CAS Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)-4-pyrazolyl]-N-propyl-4-quinolinecarboxamide IUPAC Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]-N-propylquinoline-4-carboxamide Traditional Name: 2-(5-methyl-1-p-cumenyl-pyrazol-4-yl)-N-propyl-cinchoninamide Formula: C26H28N4O MolecularWeight: 412.52672

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=C(N(N=C3)C4=CC=C(C=C4)C(C)C)C

Isomeric SMILES

CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=C(N(N=C3)C4=CC=C(C=C4)C(C)C)C

InChI

InChI=1S/C26H28N4O/c1-5-14-27-26(31)22-15-25(29-24-9-7-6-8-21(22)24)23-16-28-30(18(23)4)20-12-10-19(11-13-20)17(2)3/h6-13,15-17H,5,14H2,1-4H3,(H,27,31)