6-bromanyl-N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[(1,3-dimethyl-4-pyrazolyl)methyl]-2-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)cinchoninamide Formula: C23H21BrN4O2 MolecularWeight: 465.34244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=NN(C=C1CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)OC)C

InChI

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