4-[(2,6-dimethylquinolin-4-yl)amino]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[(2,6-dimethylquinolin-4-yl)amino]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[(2,6-dimethyl-4-quinolyl)amino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[(2,6-dimethyl-4-quinolinyl)amino]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(2,6-dimethylquinolin-4-yl)amino]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[(2,6-dimethyl-4-quinolyl)amino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C21H19N5O2S MolecularWeight: 405.47286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C

InChI

InChI=1S/C21H19N5O2S/c1-14-4-9-19-18(12-14)20(13-15(2)24-19)25-16-5-7-17(8-6-16)29(27,28)26-21-22-10-3-11-23-21/h3-13H,1-2H3,(H,24,25)(H,22,23,26)