6-bromanyl-N-[(1-ethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[(1-ethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[(1-ethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[(1-ethyl-4-pyrazolyl)methyl]-2-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[(1-ethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[(1-ethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)cinchoninamide Formula: C23H21BrN4O2 MolecularWeight: 465.34244

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1C=C(C=N1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H21BrN4O2/c1-3-28-14-15(13-26-28)12-25-23(29)20-11-22(16-4-7-18(30-2)8-5-16)27-21-9-6-17(24)10-19(20)21/h4-11,13-14H,3,12H2,1-2H3,(H,25,29)