basic_info |
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| Product_Name: | 2-[[4-(4-BROMOPHENYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2,4-DIMETHOXYPHENYL)ACETAMIDE |
| CAS: | 477330-98-6 |
| EnglishSynonyms: | 2-[[4-(4-BROMOPHENYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2,4-DIMETHOXYPHENYL)ACETAMIDE |
| pro_mdlNumber: | MFCD03224919 |
| pro_acceptors: | 8 |
| pro_donors: | 1 |
| pro_smile: | COc1ccc(c(c1)OC)NC(=O)CSc2nnc(n2c3ccc(cc3)Br)c4cccnc4 |
| InChi: | InChI=1S/C23H20BrN5O3S/c1-31-18-9-10-19(20(12-18)32-2)26-21(30)14-33-23-28-27-22(15-4-3-11-25-13-15)29(23)17-7-5-16(24)6-8-17/h3-13H,14H2,1-2H3,(H,26,30) |
| InChiKey: | InChIKey=BYXUWTFXCKZIPD-UHFFFAOYSA-N |
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