11708365 -OEChem-10051722423D 20 19 0 0 0 0 0 0 0999 V2000 -2.4265 1.4150 -1.0348 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.4295 -1.4747 -0.9217 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9085 0.0025 -0.1532 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5249 -0.1658 -1.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1649 -1.2144 0.5956 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2885 1.3052 0.3628 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 0.0074 -0.0208 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7882 0.0289 0.5658 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 0.0465 -0.6084 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -1.2330 1.4257 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6665 1.2825 1.4431 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -0.8232 -1.2638 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1199 0.9463 -1.2276 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1912 -1.1367 2.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5308 -1.3991 2.0467 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4625 -2.1422 0.8413 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5199 1.3741 2.1264 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2287 1.2368 2.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5966 2.2089 0.8633 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3991 -1.0521 -2.0678 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 2 0 0 0 0 3 9 1 0 0 0 0 4 20 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 M END > DB12197 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/QYNRGGHZWCUZLK-UHFFFAOYSA-N/SDF?record_type=3d > CC(C)(CS(O)(=O)=O)N(Cl)Cl > InChI=1S/C4H9Cl2NO3S/c1-4(2,7(5)6)3-11(8,9)10/h3H2,1-2H3,(H,8,9,10) > QYNRGGHZWCUZLK-UHFFFAOYSA-N > C4H9Cl2NO3S > 222.08 > 220.9680197 > 4 > 20 > 18.444812158236804 > 1 > 1 > 0 > 1 > 2-(dichloroamino)-2-methylpropane-1-sulfonic acid > -1.08 > 0.0022629163333332536 > -2.02 > 0 > 0 > -1 > -1.7834799931614862 > -8.439758721852309 > 57.61000000000001 > 44.7135 > 3 > 1 > 2.14e+00 g/l > 2-(dichloroamino)-2-methylpropane-1-sulfonic acid > 0 $$$$