N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]benzenesulfonamide Formula: C25H24N4O4S MolecularWeight: 476.54746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C25H24N4O4S/c1-32-22-14-17-12-13-29(16-18(17)15-23(22)33-2)25-24(26-20-10-6-7-11-21(20)27-25)28-34(30,31)19-8-4-3-5-9-19/h3-11,14-15H,12-13,16H2,1-2H3,(H,26,28)