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

Systemtic Name: N-[1-[(4-bromanylphenoxy)methyl]pyrazol-4-yl]-2-(1-ethyl-3-methyl-pyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-2-(1-ethyl-3-methyl-pyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[1-[(4-bromophenoxy)methyl]-4-pyrazolyl]-2-(1-ethyl-3-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-2-(1-ethyl-3-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-2-(1-ethyl-3-methyl-pyrazol-4-yl)cinchoninamide Formula: C26H23BrN6O2 MolecularWeight: 531.40382

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CN(N=C4)COC5=CC=C(C=C5)Br

Isomeric SMILES

CCN1C=C(C(=N1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CN(N=C4)COC5=CC=C(C=C5)Br

InChI

InChI=1S/C26H23BrN6O2/c1-3-32-15-23(17(2)31-32)25-12-22(21-6-4-5-7-24(21)30-25)26(34)29-19-13-28-33(14-19)16-35-20-10-8-18(27)9-11-20/h4-15H,3,16H2,1-2H3,(H,29,34)