N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]-1-pyridin-3-yl-methanesulfonamide

Systemtic Name: N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]-1-pyridin-3-yl-methanesulfonamide Openeye Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-1-(3-pyridyl)methanesulfonamide CAS Name: N-[3-(3,5-dimethoxyanilino)-2-quinoxalinyl]-1-(3-pyridinyl)methanesulfonamide IUPAC Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-1-pyridin-3-ylmethanesulfonamide Traditional Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-1-(3-pyridyl)methanesulfonamide Formula: C22H21N5O4S MolecularWeight: 451.49824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)CC4=CN=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)CC4=CN=CC=C4)OC

InChI

InChI=1S/C22H21N5O4S/c1-30-17-10-16(11-18(12-17)31-2)24-21-22(26-20-8-4-3-7-19(20)25-21)27-32(28,29)14-15-6-5-9-23-13-15/h3-13H,14H2,1-2H3,(H,24,25)(H,26,27)