basic_info |
|
| Product_Name： | UO126 |
| CAS： | 1173097-76-1 |
| EnglishSynonyms： | UO126 |
| pro_mdlNumber： | MFCD22628895 |
| pro_acceptors： | 6 |
| pro_donors： | 4 |
| pro_smile： | CCO.c1ccc(c(c1)N)S/C(=C(/C#N)\C(=C(\N)/Sc2ccccc2N)\C#N)/N |
| InChi： | InChI=1S/C18H16N6S2.C2H6O/c19-9-11(17(23)25-15-7-3-1-5-13(15)21)12(10-20)18(24)26-16-8-4-2-6-14(16)22;1-2-3/h1-8H,21-24H2;3H,2H2,1H3/b17-11-,18-12-; |
| InChiKey： | InChIKey=CFQULUVMLGZVAF-YIQLKAPXSA-N |
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