5560 -OEChem-10051719283D 28 29 0 1 0 0 0 0 0999 V2000 -4.8016 -1.9280 0.8883 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.2215 -0.9315 -1.7863 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.7541 -2.8402 -0.0042 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1984 2.0150 0.1052 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8657 0.1902 -0.1818 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7982 2.8986 -0.9717 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2731 2.4718 1.4786 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4837 -0.9826 -0.7934 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9271 1.4875 -0.8464 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6699 1.2642 -0.3323 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9689 -0.9845 0.2685 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5277 0.3628 1.3958 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9904 0.0341 0.4265 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1081 0.6268 0.1025 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -0.6778 0.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2609 0.8863 -0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1582 -0.1762 -0.0418 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 -0.5051 -0.0646 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3133 -1.7283 0.1442 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6856 -1.4832 0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0749 0.3001 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8896 1.2268 -1.3361 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -1.9529 0.4223 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6078 1.9146 -0.0603 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1185 0.2447 0.0398 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0449 -2.7561 0.1963 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8456 1.3102 1.6412 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9723 -0.0417 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 18 1 0 0 0 0 3 20 1 0 0 0 0 4 6 2 0 0 0 0 4 7 2 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 5 8 2 0 0 0 0 5 9 2 0 0 0 0 5 12 1 0 0 0 0 5 17 1 0 0 0 0 10 13 1 0 0 0 0 10 22 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 11 23 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 18 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 19 2 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 20 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 M END > DB01021 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/LMJSLTNSBFUCMU-UHFFFAOYSA-N/SDF?record_type=3d > NS(=O)(=O)C1=C(Cl)C=C2NC(NS(=O)(=O)C2=C1)C(Cl)Cl > InChI=1S/C8H8Cl3N3O4S2/c9-3-1-4-6(2-5(3)19(12,15)16)20(17,18)14-8(13-4)7(10)11/h1-2,7-8,13-14H,(H2,12,15,16) > LMJSLTNSBFUCMU-UHFFFAOYSA-N > C8H8Cl3N3O4S2 > 380.656 > 378.90218026 > 5 > 28 > -0.05113758710882739 > 31.970887949353504 > 1 > 3 > 0 > 1 > 6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-7-sulfonamide > 0.86 > 0.9733494586666664 > -2.96 > 0 > 0 > 2 > 0 > 9.532196642422337 > 8.322179814553696 > -4.055106429314076 > 118.36 > 77.4351 > 2 > 1 > 4.15e-01 g/l > tetrahydrofolic acid > 0 $$$$