basic_info |
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| Product_Name: | 3-(6-ETHYL-5-METHYL-2-P-TOLYL-PYRIMIDIN-4-YLAMINO)-BENZOIC ACID |
| EnglishSynonyms: | 3-(6-ETHYL-5-METHYL-2-P-TOLYL-PYRIMIDIN-4-YLAMINO)-BENZOIC ACID |
| pro_mdlNumber: | MFCD16812004 |
| pro_acceptors: | 5 |
| pro_donors: | 2 |
| pro_smile: | CCc1c(c(nc(n1)c2ccc(cc2)C)Nc3cccc(c3)C(=O)O)C |
| InChi: | InChI=1S/C21H21N3O2/c1-4-18-14(3)19(22-17-7-5-6-16(12-17)21(25)26)24-20(23-18)15-10-8-13(2)9-11-15/h5-12H,4H2,1-3H3,(H,25,26)(H,22,23,24) |
| InChiKey: | InChIKey=MERQQFRHVSANAX-UHFFFAOYSA-N |
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