2727 -OEChem-10051719203D 30 30 0 0 0 0 0 0 0999 V2000 4.2498 -2.8279 -0.1742 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3928 2.0876 0.1512 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2245 2.6187 -1.1877 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8819 2.9342 1.2221 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8268 0.6013 -1.4333 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0584 1.3325 0.6475 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0756 0.1610 0.4616 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 -0.5466 -0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4824 0.6989 0.0592 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8887 -2.0454 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9921 0.6815 -0.2198 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 0.0020 -1.1318 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2081 0.3339 1.1801 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7448 -2.6996 1.0838 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4498 -1.0939 -1.2043 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 -0.7621 1.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1889 -1.4760 -0.0846 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2872 -0.1360 -1.2003 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0636 -0.3500 0.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 -2.5201 -0.8198 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9782 -2.2330 -0.8644 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2938 1.3884 1.6465 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1174 0.2749 1.4697 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0207 0.2812 -2.0129 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1223 0.8712 2.1195 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6344 -2.5257 1.6974 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6173 -3.7810 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -2.3156 1.6226 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5332 -1.6417 -2.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6364 -1.0495 1.9884 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 6 1 0 0 0 0 2 9 1 0 0 0 0 5 11 2 0 0 0 0 6 11 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 23 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 12 15 1 0 0 0 0 12 24 1 0 0 0 0 13 16 2 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 17 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 M END > DB00672 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/RKWGIWYCVPQPMF-UHFFFAOYSA-N/SDF?record_type=3d > CCCNC(=O)NS(=O)(=O)C1=CC=C(Cl)C=C1 > InChI=1S/C10H13ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3,(H2,12,13,14) > RKWGIWYCVPQPMF-UHFFFAOYSA-N > C10H13ClN2O3S > 276.74 > 276.033540689 > 3 > 30 > -0.999786659129283 > 27.057077096869495 > 1 > 2 > 0 > 1 > 1-(4-chlorobenzenesulfonyl)-3-propylurea > 2.15 > 1.941390449333333 > -3.25 > 0 > -1 > 1 > -1 > 17.470932276511157 > 3.3291667947251957 > 75.27 > 65.43260000000001 > 3 > 1 > 1.57e-01 g/l > tetrahydrofolic acid > 0 $$$$