basic_info |
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| Product_Name: | 2-[[4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-ETHYLPHENYL)ACETAMIDE |
| CAS: | 538336-83-3 |
| EnglishSynonyms: | 2-[[4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-ETHYLPHENYL)ACETAMIDE |
| pro_mdlNumber: | MFCD04211428 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | CCc1ccc(cc1)NC(=O)CSc2nnc(n2Cc3ccccc3)COc4ccccc4 |
| InChi: | InChI=1S/C26H26N4O2S/c1-2-20-13-15-22(16-14-20)27-25(31)19-33-26-29-28-24(18-32-23-11-7-4-8-12-23)30(26)17-21-9-5-3-6-10-21/h3-16H,2,17-19H2,1H3,(H,27,31) |
| InChiKey: | InChIKey=KNXDWMWFMKWIBI-UHFFFAOYSA-N |
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