basic_info |
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| Product_Name: | TRANS-1-((2-(2-BENZOFURANYL)-5-BUTYL-5-ETHYL-1,3-DIOXAN-2-YL)METHYL)-1H-1,2,4-TRIAZOLE |
| CAS: | 98519-37-0 |
| EnglishSynonyms: | TRANS-1-((2-(2-BENZOFURANYL)-5-BUTYL-5-ETHYL-1,3-DIOXAN-2-YL)METHYL)-1H-1,2,4-TRIAZOLE |
| pro_mdlNumber: | MFCD01761014 |
| pro_acceptors: | 6 |
| pro_donors: | 0 |
| pro_smile: | CCCC[C@]1(CO[C@](OC1)(Cn2cncn2)c3cc4ccccc4o3)CC |
| InChi: | InChI=1S/C21H27N3O3/c1-3-5-10-20(4-2)13-25-21(26-14-20,12-24-16-22-15-23-24)19-11-17-8-6-7-9-18(17)27-19/h6-9,11,15-16H,3-5,10,12-14H2,1-2H3/t20-,21- |
| InChiKey: | InChIKey=ZIBLQCIVFVPAHQ-MEMLXQNLSA-N |
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