12894 -OEChem-10051721283D 31 32 0 0 0 0 0 0 0999 V2000 -0.3144 1.0098 0.0686 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 0.7712 0.0068 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2325 2.1312 -0.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0755 1.1998 1.4603 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5452 -0.3216 -0.5979 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6909 -1.4458 -0.4402 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8826 -1.0751 0.0197 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9492 0.3972 0.0544 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0017 -0.3449 -0.3409 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9544 0.3192 0.1449 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -1.0263 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4429 -0.2994 1.1573 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7618 0.6047 -1.0602 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7492 -0.7886 1.1458 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0681 0.1157 -1.0717 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5617 -0.5810 0.0313 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9735 1.3031 0.5249 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0858 -1.9691 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0958 -1.2407 -0.6876 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8257 -0.4792 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3959 1.1387 -1.9326 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1218 -1.3314 2.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6912 0.2826 -1.9467 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9583 0.8376 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0496 2.0892 -0.2327 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7184 1.7710 1.4806 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5430 -2.0136 0.8765 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7586 -2.9791 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8519 -1.6627 -0.8361 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2409 -1.5809 0.8187 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4719 -0.9255 -0.7884 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 5 1 0 0 0 0 1 8 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 9 2 0 0 0 0 6 11 1 0 0 0 0 7 16 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 18 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 13 15 2 0 0 0 0 13 21 1 0 0 0 0 14 16 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 M END > DB08798 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/CYFLXLSBHQBMFT-UHFFFAOYSA-N/SDF?record_type=3d > CC1=C(C)N=C(NS(=O)(=O)C2=CC=C(N)C=C2)O1 > InChI=1S/C11H13N3O3S/c1-7-8(2)17-11(13-7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6H,12H2,1-2H3,(H,13,14) > CYFLXLSBHQBMFT-UHFFFAOYSA-N > C11H13N3O3S > 267.304 > 267.067761987 > 4 > 31 > -0.6083757022239532 > 27.444221094065718 > 1 > 2 > 0 > 1 > 4-amino-N-(4,5-dimethyl-1,3-oxazol-2-yl)benzene-1-sulfonamide > 1.04 > 0.5890580276666666 > -3.00 > 0 > -1 > 2 > -1 > 6.808689436128983 > 1.935602726549716 > 98.22 > 67.51450000000001 > 2 > 1 > 2.67e-01 g/l > tetrahydrofolic acid > 0 $$$$