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

Systemtic Name: 6-bromanyl-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]-2-(4-pyridyl)cinchoninamide Formula: C28H24BrN5O MolecularWeight: 526.42706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=NC=C5)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=NC=C5)C

InChI

InChI=1S/C28H24BrN5O/c1-17-6-4-5-7-21(17)16-34-19(3)27(18(2)33-34)32-28(35)24-15-26(20-10-12-30-13-11-20)31-25-9-8-22(29)14-23(24)25/h4-15H,16H2,1-3H3,(H,32,35)