N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(1-ethyl-5-methyl-pyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(1-ethyl-5-methyl-pyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(1-ethyl-5-methyl-pyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-2-(1-ethyl-5-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(1-ethyl-5-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[4-bromo-1-(2-chlorobenzyl)pyrazol-3-yl]-2-(1-ethyl-5-methyl-pyrazol-4-yl)cinchoninamide Formula: C26H22BrClN6O MolecularWeight: 549.84948

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NN(C=C4Br)CC5=CC=CC=C5Cl)C

Isomeric SMILES

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NN(C=C4Br)CC5=CC=CC=C5Cl)C

InChI

InChI=1S/C26H22BrClN6O/c1-3-34-16(2)20(13-29-34)24-12-19(18-9-5-7-11-23(18)30-24)26(35)31-25-21(27)15-33(32-25)14-17-8-4-6-10-22(17)28/h4-13,15H,3,14H2,1-2H3,(H,31,32,35)