N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-2-(1-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[4-bromo-1-(2-chlorobenzyl)pyrazol-3-yl]-2-(1-methylpyrazol-4-yl)cinchoninamide Formula: C24H18BrClN6O MolecularWeight: 521.79632

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NN(C=C4Br)CC5=CC=CC=C5Cl

Isomeric SMILES

CN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NN(C=C4Br)CC5=CC=CC=C5Cl

InChI

InChI=1S/C24H18BrClN6O/c1-31-12-16(11-27-31)22-10-18(17-7-3-5-9-21(17)28-22)24(33)29-23-19(25)14-32(30-23)13-15-6-2-4-8-20(15)26/h2-12,14H,13H2,1H3,(H,29,30,33)