N-[3-[(4-bromanyl-2-methyl-phenyl)amino]quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[3-[(4-bromanyl-2-methyl-phenyl)amino]quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[3-(4-bromo-2-methyl-anilino)quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[3-(4-bromo-2-methylanilino)-2-quinoxalinyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[3-(4-bromo-2-methylanilino)quinoxalin-2-yl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[3-(4-bromo-2-methyl-anilino)quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide Formula: C23H21BrN4O2S MolecularWeight: 497.40744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21BrN4O2S/c1-14-8-9-15(2)21(12-14)31(29,30)28-23-22(25-18-11-10-17(24)13-16(18)3)26-19-6-4-5-7-20(19)27-23/h4-13H,1-3H3,(H,25,26)(H,27,28)