N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[1-(o-tolylmethyl)pyrazol-4-yl]-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-2-(1,3,5-trimethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[1-(2-methylbenzyl)pyrazol-4-yl]-2-(1,3,5-trimethylpyrazol-4-yl)cinchoninamide Formula: C27H26N6O MolecularWeight: 450.53494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=C(N(N=C5C)C)C

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=C(N(N=C5C)C)C

InChI

InChI=1S/C27H26N6O/c1-17-9-5-6-10-20(17)15-33-16-21(14-28-33)29-27(34)23-13-25(26-18(2)31-32(4)19(26)3)30-24-12-8-7-11-22(23)24/h5-14,16H,15H2,1-4H3,(H,29,34)