23647652 -OEChem-12142311563D 37 39 0 0 0 0 0 0 0999 V2000 5.2781 -0.7547 -0.4756 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9335 -1.2909 0.3864 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1404 1.0487 -0.1621 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1753 -1.7942 -1.4918 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2635 0.3061 -0.6382 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 0.2667 -0.7222 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5228 -1.4984 1.0436 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4073 -1.8318 -0.1688 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 -3.7011 0.4842 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2157 1.1987 0.0267 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7142 -0.0037 -0.2796 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0767 1.8186 0.1883 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3737 1.9024 0.3579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3071 -0.1063 -0.4574 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6229 1.3013 0.2047 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5564 -0.7074 -0.6106 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4973 3.0512 0.6305 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2521 1.7981 0.0584 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 3.0380 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5529 1.3076 -0.1998 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9332 0.0183 -0.0874 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5756 -2.5157 1.5218 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3095 -0.4666 -0.3662 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2963 -2.3847 0.2109 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3346 2.9193 0.7393 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4286 -0.6872 -0.7257 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5109 1.8656 0.4753 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6039 -1.7256 -0.9865 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1224 3.8674 0.9738 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5867 3.8386 0.8108 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 -0.9702 1.7719 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3042 2.0468 -0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1935 -3.1259 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7473 -2.0379 2.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0945 -3.1783 2.2205 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 -4.3888 0.4037 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1608 -4.0322 0.7757 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 2 21 1 0 0 0 0 2 24 1 0 0 0 0 3 12 1 0 0 0 0 3 18 1 0 0 0 0 6 23 2 0 0 0 0 7 22 1 0 0 0 0 7 31 1 0 0 0 0 8 23 1 0 0 0 0 8 24 2 0 0 0 0 9 24 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 12 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 17 2 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 14 16 2 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 23 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 M END > DB07533 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/FJJJERLTHDXEPT-JYRVWZFOSA-N/SDF?record_type=3d > CNS(=O)(=O)C1=CC=C(C=C1)C1=CC=C(O1)\C=C1/SC(=N)NC1=O > InChI=1S/C15H13N3O4S2/c1-17-24(20,21)11-5-2-9(3-6-11)12-7-4-10(22-12)8-13-14(19)18-15(16)23-13/h2-8,17H,1H3,(H2,16,18,19)/b13-8- > FJJJERLTHDXEPT-JYRVWZFOSA-N > C15H13N3O4S2 > 363.411 > 363.034747299 > 4 > 37 > 0.9682466493257011 > 36.29851589797481 > 1 > 3 > 0 > 1 > 4-(5-{[(5Z)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)-N-methylbenzene-1-sulfonamide > 1.3198004533333334 > 0 > 0 > 3 > 0 > 10.906129797124615 > 9.937474624439673 > 1.4802978020514053 > 112.25999999999999 > 103.15220000000002 > 3 > 1 > 4-(5-{[(5Z)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)-N-methylbenzenesulfonamide > 0 $$$$