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

Systemtic Name: N-[3-[(4-bromophenyl)amino]-6,7-dimethyl-quinoxalin-2-yl]-3-chloranyl-benzenesulfonamide Openeye Name: N-[3-(4-bromoanilino)-6,7-dimethyl-quinoxalin-2-yl]-3-chloro-benzenesulfonamide CAS Name: N-[3-(4-bromoanilino)-6,7-dimethyl-2-quinoxalinyl]-3-chlorobenzenesulfonamide IUPAC Name: N-[3-(4-bromoanilino)-6,7-dimethylquinoxalin-2-yl]-3-chlorobenzenesulfonamide Traditional Name: N-[3-(4-bromoanilino)-6,7-dimethyl-quinoxalin-2-yl]-3-chloro-benzenesulfonamide Formula: C22H18BrClN4O2S MolecularWeight: 517.82592

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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=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H18BrClN4O2S/c1-13-10-19-20(11-14(13)2)27-22(21(26-19)25-17-8-6-15(23)7-9-17)28-31(29,30)18-5-3-4-16(24)12-18/h3-12H,1-2H3,(H,25,26)(H,27,28)