4-bromanyl-N-[3-[(3-chloranyl-4-methoxy-phenyl)amino]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-[(3-chloranyl-4-methoxy-phenyl)amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-(3-chloro-4-methoxy-anilino)quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-bromo-N-[3-(3-chloro-4-methoxyanilino)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-(3-chloro-4-methoxyanilino)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-(3-chloro-4-methoxy-anilino)quinoxalin-2-yl]benzenesulfonamide Formula: C21H16BrClN4O3S MolecularWeight: 519.79874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)Br)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)Br)Cl

InChI

InChI=1S/C21H16BrClN4O3S/c1-30-19-11-8-14(12-16(19)23)24-20-21(26-18-5-3-2-4-17(18)25-20)27-31(28,29)15-9-6-13(22)7-10-15/h2-12H,1H3,(H,24,25)(H,26,27)