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

Systemtic Name: 6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-N-(phenylmethyl)quinoline-4-carboxamide Openeye Name: N-benzyl-6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]quinoline-4-carboxamide CAS Name: 6-methyl-2-[5-methyl-1-(4-methylphenyl)-4-pyrazolyl]-N-(phenylmethyl)-4-quinolinecarboxamide IUPAC Name: N-benzyl-6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-benzyl-6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]cinchoninamide Formula: C29H26N4O MolecularWeight: 446.54294

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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=CC=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=CC=CC=C5)C

InChI

InChI=1S/C29H26N4O/c1-19-9-12-23(13-10-19)33-21(3)26(18-31-33)28-16-25(24-15-20(2)11-14-27(24)32-28)29(34)30-17-22-7-5-4-6-8-22/h4-16,18H,17H2,1-3H3,(H,30,34)