6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide Openeye Name: 6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]-N-(3-pyridylmethyl)quinoline-4-carboxamide CAS Name: 6-methyl-2-[5-methyl-1-(4-methylphenyl)-4-pyrazolyl]-N-(3-pyridinylmethyl)-4-quinolinecarboxamide IUPAC Name: 6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide Traditional Name: 6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]-N-(3-pyridylmethyl)cinchoninamide Formula: C28H25N5O MolecularWeight: 447.531

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)NCC5=CN=CC=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)NCC5=CN=CC=C5)C

InChI

InChI=1S/C28H25N5O/c1-18-6-9-22(10-7-18)33-20(3)25(17-31-33)27-14-24(23-13-19(2)8-11-26(23)32-27)28(34)30-16-21-5-4-12-29-15-21/h4-15,17H,16H2,1-3H3,(H,30,34)