basic_info |
|
| Product_Name： | BE 10988 |
| CAS： | 135261-89-1 |
| EnglishSynonyms： | BE 10988 |
| pro_mdlNumber： | MFCD00906443 |
| pro_acceptors： | 7 |
| pro_donors： | 2 |
| pro_smile： | Cn1cc(c2c1C(=O)C=C(C2=O)N)c3nc(cs3)C(=O)N |
| InChi： | InChI=1S/C13H10N4O3S/c1-17-3-5(13-16-7(4-21-13)12(15)20)9-10(17)8(18)2-6(14)11(9)19/h2-4H,14H2,1H3,(H2,15,20) |
| InChiKey： | InChIKey=ZLMULFPSOBULMS-UHFFFAOYSA-N |
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