basic_info |
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| Product_Name: | 2-[[4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2,5-DIMETHYLPHENYL)ACETAMIDE |
| CAS: | 539812-50-5 |
| EnglishSynonyms: | 2-[[4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2,5-DIMETHYLPHENYL)ACETAMIDE |
| pro_mdlNumber: | MFCD05154919 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | Cc1ccc(c(c1)NC(=O)CSc2nnc(n2Cc3ccccc3)COc4ccccc4)C |
| InChi: | InChI=1S/C26H26N4O2S/c1-19-13-14-20(2)23(15-19)27-25(31)18-33-26-29-28-24(17-32-22-11-7-4-8-12-22)30(26)16-21-9-5-3-6-10-21/h3-15H,16-18H2,1-2H3,(H,27,31) |
| InChiKey: | InChIKey=INRHJSOUZFUNRH-UHFFFAOYSA-N |
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