3-methyl-N-[3-[(4-sulfamoylphenyl)amino]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 3-methyl-N-[3-[(4-sulfamoylphenyl)amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 3-methyl-N-[3-(4-sulfamoylanilino)quinoxalin-2-yl]benzenesulfonamide CAS Name: 3-methyl-N-[3-(4-sulfamoylanilino)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 3-methyl-N-[3-(4-sulfamoylanilino)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 3-methyl-N-[3-(4-sulfamoylanilino)quinoxalin-2-yl]benzenesulfonamide Formula: C21H19N5O4S2 MolecularWeight: 469.53666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C21H19N5O4S2/c1-14-5-4-6-17(13-14)32(29,30)26-21-20(24-18-7-2-3-8-19(18)25-21)23-15-9-11-16(12-10-15)31(22,27)28/h2-13H,1H3,(H,23,24)(H,25,26)(H2,22,27,28)