N-[3-[bis(2-methylpropyl)amino]quinoxalin-2-yl]-4-bromanyl-benzenesulfonamide

Systemtic Name: N-[3-[bis(2-methylpropyl)amino]quinoxalin-2-yl]-4-bromanyl-benzenesulfonamide Openeye Name: 4-bromo-N-[3-(diisobutylamino)quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-[bis(2-methylpropyl)amino]-2-quinoxalinyl]-4-bromobenzenesulfonamide IUPAC Name: N-[3-[bis(2-methylpropyl)amino]quinoxalin-2-yl]-4-bromobenzenesulfonamide Traditional Name: 4-bromo-N-[3-(diisobutylamino)quinoxalin-2-yl]benzenesulfonamide Formula: C22H27BrN4O2S MolecularWeight: 491.44438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=NC2=CC=CC=C2N=C1NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)CN(CC(C)C)C1=NC2=CC=CC=C2N=C1NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H27BrN4O2S/c1-15(2)13-27(14-16(3)4)22-21(24-19-7-5-6-8-20(19)25-22)26-30(28,29)18-11-9-17(23)10-12-18/h5-12,15-16H,13-14H2,1-4H3,(H,24,26)