basic_info |
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Product_Name: | 5-[(3-ETHYL-3-HYDROXYAZETIDIN-1-YL)SULFONYL]-2-FLUOROBENZONITRILE |
EnglishSynonyms: | 5-[(3-ETHYL-3-HYDROXYAZETIDIN-1-YL)SULFONYL]-2-FLUOROBENZONITRILE |
pro_mdlNumber: | MFCD20865624 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | CCC1(CN(C1)S(=O)(=O)c2ccc(c(c2)C#N)F)O |
InChi: | InChI=1S/C12H13FN2O3S/c1-2-12(16)7-15(8-12)19(17,18)10-3-4-11(13)9(5-10)6-14/h3-5,16H,2,7-8H2,1H3 |
InChiKey: | InChIKey=KMRMKOOCEFOJPQ-UHFFFAOYSA-N |
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