"-3.5" . "0" . "3" . "64.55" . "0.1" . "46.0254" . "ALOGPS" . "isothipendyl" . "C16H14N2O4" . "SANGSTER (1994)" . "ChemAxon" . "1" . "49.45" . "0.63" . "InChI=1S/C23H24N2O4S/c1-2-3-6-21-24-14-19(12-18(23(28)29)13-20-5-4-11-30-20)25(21)15-16-7-9-17(10-8-16)22(26)27/h4-5,7-12,14H,2-3,6,13,15H2,1H3,(H,26,27)(H,28,29)/b18-12+" . "0.81" . "360.072252042" .