44144383 -OEChem-10051721143D 26 28 0 0 0 0 0 0 0999 V2000 -4.2975 0.5108 -0.0877 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8284 -0.2774 0.0431 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2887 1.8403 -0.6797 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1536 -0.5256 -0.6453 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9356 0.8721 -0.0366 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3087 -1.3184 0.0069 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6211 0.6517 1.5836 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8489 1.3843 -0.0112 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3057 0.2893 -0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -1.0781 -0.0118 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6546 -0.0876 -0.0574 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5941 0.8244 -0.0627 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8665 -0.1285 -0.0088 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1235 -1.9799 -0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4258 -1.4652 -0.0299 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3224 0.1073 0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2393 -0.9224 0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1608 1.3030 0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7484 1.8974 -0.0777 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1249 1.8657 -0.0524 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9558 -3.0520 0.0161 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2545 -2.1689 -0.0188 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0704 -1.9904 0.0491 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6875 1.5977 1.9785 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2772 -0.0198 2.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7915 2.1814 0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 5 20 1 0 0 0 0 6 10 1 0 0 0 0 6 13 2 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 16 1 0 0 0 0 8 18 2 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 19 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 17 23 1 0 0 0 0 18 26 1 0 0 0 0 M END > DB08083 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/KGMVTZZDGKDTEU-UHFFFAOYSA-N/SDF?record_type=3d > NS(=O)(=O)C1=CC=C2NC(=NC2=C1)C1=CSC=N1 > InChI=1S/C10H8N4O2S2/c11-18(15,16)6-1-2-7-8(3-6)14-10(13-7)9-4-17-5-12-9/h1-5H,(H,13,14)(H2,11,15,16) > KGMVTZZDGKDTEU-UHFFFAOYSA-N > C10H8N4O2S2 > 280.326 > 280.0088669 > 4 > 26 > -0.0061073227561869135 > 27.259615111596194 > 1 > 2 > 0 > 1 > 2-(1,3-thiazol-4-yl)-1H-1,3-benzodiazole-5-sulfonamide > 1.31 > 0.9349481240000002 > -2.91 > 0 > 0 > 3 > 0 > 10.109925557703539 > 9.286808106019661 > 2.667105690188577 > 101.73 > 77.0644 > 2 > 1 > 3.46e-01 g/l > biotin > 0 $$$$