basic_info |
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| Product_Name: | N-(2-TERT-BUTYLPHENYL)-2-[[4-ETHYL-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETAMIDE |
| CAS: | 573705-53-0 |
| EnglishSynonyms: | N-(2-TERT-BUTYLPHENYL)-2-[[4-ETHYL-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETAMIDE |
| pro_mdlNumber: | MFCD04018011 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | CCn1c(nnc1SCC(=O)Nc2ccccc2C(C)(C)C)c3cccnc3 |
| InChi: | InChI=1S/C21H25N5OS/c1-5-26-19(15-9-8-12-22-13-15)24-25-20(26)28-14-18(27)23-17-11-7-6-10-16(17)21(2,3)4/h6-13H,5,14H2,1-4H3,(H,23,27) |
| InChiKey: | InChIKey=VQUVVUCYGGHNBL-UHFFFAOYSA-N |
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