basic_info |
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Product_Name: | [7-ETHYL-8-METHYL-3-OXO-5-(4-TRIFLUOROMETHYL-PHENYL)-[1,2,4]TRIAZOLO[4,3-C]PYRIMIDIN-2-YL]-ACETIC ACID |
EnglishSynonyms: | [7-ETHYL-8-METHYL-3-OXO-5-(4-TRIFLUOROMETHYL-PHENYL)-[1,2,4]TRIAZOLO[4,3-C]PYRIMIDIN-2-YL]-ACETIC ACID |
pro_mdlNumber: | MFCD16813425 |
pro_acceptors: | 7 |
pro_donors: | 1 |
pro_smile: | CCc1c(c2nn(c(=O)n2c(n1)c3ccc(cc3)C(F)(F)F)CC(=O)O)C |
InChi: | InChI=1S/C17H15F3N4O3/c1-3-12-9(2)14-22-23(8-13(25)26)16(27)24(14)15(21-12)10-4-6-11(7-5-10)17(18,19)20/h4-7H,3,8H2,1-2H3,(H,25,26) |
InChiKey: | InChIKey=BUNVTXIJCBYBIE-UHFFFAOYSA-N |
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