N-[3-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methylamino]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: N-[3-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methylamino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]methylamino]quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]methylamino]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methylamino]quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[3-[[6-(4-methylpiperazino)-3-pyridyl]methylamino]quinoxalin-2-yl]benzenesulfonamide Formula: C25H27N7O2S MolecularWeight: 489.59258

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)CNC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)CNC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H27N7O2S/c1-31-13-15-32(16-14-31)23-12-11-19(17-26-23)18-27-24-25(29-22-10-6-5-9-21(22)28-24)30-35(33,34)20-7-3-2-4-8-20/h2-12,17H,13-16,18H2,1H3,(H,27,28)(H,29,30)