23647659 -OEChem-10051721043D 37 39 0 0 0 0 0 0 0999 V2000 5.7137 1.0383 -0.2515 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8263 1.2310 0.8653 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6953 -0.8247 -0.2187 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5302 2.4478 -0.5684 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5454 0.6538 0.8804 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6483 -0.0638 -1.3324 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 0.2287 -1.6463 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1485 1.8424 -0.1115 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1471 3.5141 1.2673 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6239 -0.8547 0.2601 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3233 -1.4574 0.4207 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8228 -1.5337 0.0497 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0868 -1.1577 -0.4604 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1399 0.3080 -0.0568 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1415 -2.5629 1.0942 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5353 -2.6123 0.8534 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7384 -1.4253 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7676 0.2972 -0.5133 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9964 -0.8440 0.7166 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0255 0.8786 -0.6717 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5875 0.0634 -0.1324 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9446 -2.0456 -1.3573 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9006 0.5739 -0.6032 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1977 2.3049 0.6411 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4372 -3.2559 1.6884 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2358 -3.3475 1.2248 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6587 -2.3233 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9237 0.7700 -1.0093 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8517 -1.3083 1.1995 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1154 1.7720 -1.2833 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8922 -2.3123 -0.8786 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1013 -1.5962 -2.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4216 -2.9925 -1.5409 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -0.4574 -1.5266 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3412 0.7684 -2.5181 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9035 4.1842 1.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3512 3.7801 1.8369 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 14 1 0 0 0 0 2 21 1 0 0 0 0 2 24 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 6 23 2 0 0 0 0 7 34 1 0 0 0 0 7 35 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 11 1 0 0 0 0 10 17 2 0 0 0 0 10 18 1 0 0 0 0 11 15 2 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 21 2 0 0 0 0 13 22 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 18 20 2 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 21 23 1 0 0 0 0 22 31 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 M END > DB07540 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/AKFVRSQELXTCFW-JYRVWZFOSA-N/SDF?record_type=3d > C\C(C1=CC=C(O1)C1=CC=C(C=C1)S(N)(=O)=O)=C1\SC(=N)NC1=O > InChI=1S/C15H13N3O4S2/c1-8(13-14(19)18-15(16)23-13)11-6-7-12(22-11)9-2-4-10(5-3-9)24(17,20)21/h2-7H,1H3,(H2,16,18,19)(H2,17,20,21)/b13-8- > AKFVRSQELXTCFW-JYRVWZFOSA-N > C15H13N3O4S2 > 363.411 > 363.034747299 > 4 > 37 > -0.0012089204787939915 > 35.87984155680461 > 1 > 3 > 0 > 1 > 4-(5-{1-[(5Z)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]ethyl}furan-2-yl)benzene-1-sulfonamide > 1.93 > 1.3955189926666667 > -3.50 > 0 > 0 > 3 > 0 > 10.90292093755946 > 9.971368138382983 > 1.431463011070133 > 126.25 > 102.5375 > 3 > 1 > 1.15e-01 g/l > biotin > 0 $$$$