4-bromanyl-N-[3-[(3,4-dimethylphenyl)amino]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-[(3,4-dimethylphenyl)amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-(3,4-dimethylanilino)quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-bromo-N-[3-(3,4-dimethylanilino)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-(3,4-dimethylanilino)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-(3,4-dimethylanilino)quinoxalin-2-yl]benzenesulfonamide Formula: C22H19BrN4O2S MolecularWeight: 483.38086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C22H19BrN4O2S/c1-14-7-10-17(13-15(14)2)24-21-22(26-20-6-4-3-5-19(20)25-21)27-30(28,29)18-11-8-16(23)9-12-18/h3-13H,1-2H3,(H,24,25)(H,26,27)