4-[[(6-bromanylquinolin-8-yl)amino]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[(6-bromanylquinolin-8-yl)amino]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[(6-bromo-8-quinolyl)amino]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[(6-bromo-8-quinolinyl)amino]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[(6-bromoquinolin-8-yl)amino]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: 4-[[(6-bromo-8-quinolyl)amino]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C20H15BrN4O MolecularWeight: 407.2633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2=C3C(=CC(=C2)Br)C=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1=CNC2=C3C(=CC(=C2)Br)C=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H15BrN4O/c1-13-17(20(26)25(24-13)16-7-3-2-4-8-16)12-23-18-11-15(21)10-14-6-5-9-22-19(14)18/h2-12,23H,1H3