N-[3-[(4-bromophenyl)amino]-6,7-dimethyl-quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[3-[(4-bromophenyl)amino]-6,7-dimethyl-quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-(4-bromoanilino)-6,7-dimethyl-quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-(4-bromoanilino)-6,7-dimethyl-2-quinoxalinyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-(4-bromoanilino)-6,7-dimethylquinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-(4-bromoanilino)-6,7-dimethyl-quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide Formula: C23H18BrF3N4O2S MolecularWeight: 551.37883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(C(=N2)NC3=CC=C(C=C3)Br)NS(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(C(=N2)NC3=CC=C(C=C3)Br)NS(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C23H18BrF3N4O2S/c1-13-11-18-19(12-14(13)2)30-22(21(29-18)28-16-9-7-15(24)8-10-16)31-34(32,33)20-6-4-3-5-17(20)23(25,26)27/h3-12H,1-2H3,(H,28,29)(H,30,31)