5215 -OEChem-10051719133D 27 28 0 0 0 0 0 0 0999 V2000 0.1398 2.1322 -0.1283 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4247 3.2677 0.5914 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6069 2.3289 -1.4952 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4133 1.4731 0.8269 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -2.2199 -0.1088 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -0.8093 1.3641 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5685 0.0813 -0.6873 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0497 0.8542 -0.1226 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 0.8146 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0239 -0.1274 -1.1134 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9505 -1.1878 -0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9763 -0.2065 0.8778 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9743 -1.1484 -1.1085 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9145 0.1704 0.4806 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1542 -2.0175 1.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0241 -1.1541 -0.9808 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8452 -2.2516 -0.1636 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 1.5638 1.6588 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -0.1174 -1.8983 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3068 1.6038 1.8414 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 -0.2274 1.6598 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9434 -1.9077 -1.8857 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -2.2502 0.6136 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8924 -2.9327 -0.8259 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9637 -2.8194 1.7129 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5544 -1.2408 -1.9231 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2213 -3.2316 -0.4246 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 4 14 1 0 0 0 0 4 20 1 0 0 0 0 5 11 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 14 1 0 0 0 0 6 15 2 0 0 0 0 7 14 2 0 0 0 0 7 16 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 12 1 0 0 0 0 9 18 1 0 0 0 0 10 13 2 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 M END > DB00359 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/SEEPANYCNGTZFQ-UHFFFAOYSA-N/SDF?record_type=3d > NC1=CC=C(C=C1)S(=O)(=O)NC1=NC=CC=N1 > InChI=1S/C10H10N4O2S/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10/h1-7H,11H2,(H,12,13,14) > SEEPANYCNGTZFQ-UHFFFAOYSA-N > C10H10N4O2S > 250.277 > 250.052446274 > 5 > 27 > -0.505798267759741 > 24.343386002678034 > 1 > 2 > 0 > 1 > 4-amino-N-(pyrimidin-2-yl)benzene-1-sulfonamide > 0.25 > 0.38726080800000007 > -2.62 > 0 > -1 > 2 > -1 > 6.989915418119709 > 2.0129080979522933 > 97.97 > 64.20090000000002 > 2 > 1 > 6.01e-01 g/l > biotin > 0 $$$$