basic_info |
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Product_Name: | 4-(4-TERT-BUTYL-6-HYDROXY-PYRIMIDIN-2-YLAMINO)-BENZONITRILE |
EnglishSynonyms: | 4-(4-TERT-BUTYL-6-HYDROXY-PYRIMIDIN-2-YLAMINO)-BENZONITRILE |
pro_mdlNumber: | MFCD16993567 |
pro_acceptors: | 5 |
pro_donors: | 2 |
pro_smile: | CC(C)(C)c1cc(nc(n1)Nc2ccc(cc2)C#N)O |
InChi: | InChI=1S/C15H16N4O/c1-15(2,3)12-8-13(20)19-14(18-12)17-11-6-4-10(9-16)5-7-11/h4-8H,1-3H3,(H2,17,18,19,20) |
InChiKey: | InChIKey=IEABQFCDCDVMPE-UHFFFAOYSA-N |
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