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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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