basic_info |
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| Product_Name: | N-(2,5-DIMETHYLPHENYL)-2-([4-PHENYL-5-[(4-PROPYLPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETAMIDE |
| CAS: | 539809-12-6 |
| EnglishSynonyms: | N-(2,5-DIMETHYLPHENYL)-2-([4-PHENYL-5-[(4-PROPYLPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETAMIDE |
| pro_mdlNumber: | MFCD03460727 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | CCCc1ccc(cc1)OCc2nnc(n2c3ccccc3)SCC(=O)Nc4cc(ccc4C)C |
| InChi: | InChI=1S/C28H30N4O2S/c1-4-8-22-13-15-24(16-14-22)34-18-26-30-31-28(32(26)23-9-6-5-7-10-23)35-19-27(33)29-25-17-20(2)11-12-21(25)3/h5-7,9-17H,4,8,18-19H2,1-3H3,(H,29,33) |
| InChiKey: | InChIKey=UMNHBNBYYLEDBI-UHFFFAOYSA-N |
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