basic_info |
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| Product_Name: | 2-[[5-(4-TERT-BUTYLPHENYL)-4-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-1-(4-CHLOROPHENYL)ETHANONE |
| CAS: | 585553-89-5 |
| EnglishSynonyms: | 2-[[5-(4-TERT-BUTYLPHENYL)-4-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-1-(4-CHLOROPHENYL)ETHANONE |
| pro_mdlNumber: | MFCD03474129 |
| pro_acceptors: | 5 |
| pro_donors: | 0 |
| pro_smile: | CC(C)(C)c1ccc(cc1)c2nnc(n2c3ccc(cc3)OC)SCC(=O)c4ccc(cc4)Cl |
| InChi: | InChI=1S/C27H26ClN3O2S/c1-27(2,3)20-9-5-19(6-10-20)25-29-30-26(31(25)22-13-15-23(33-4)16-14-22)34-17-24(32)18-7-11-21(28)12-8-18/h5-16H,17H2,1-4H3 |
| InChiKey: | InChIKey=ARSWPOPNHVHVQJ-UHFFFAOYSA-N |
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