basic_info |
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| Product_Name: | (5,6-DIPHENYL-[1,2,4]TRIAZIN-3-YLSULFANYL)ACETIC ACID |
| EnglishSynonyms: | (5,6-DIPHENYL-[1,2,4]TRIAZIN-3-YLSULFANYL)ACETIC ACID ; 2-((5,6-DIPHENYL-1,2,4-TRIAZIN-3-YL)THIO)ACETIC ACID |
| pro_mdlNumber: | MFCD00778465 |
| pro_acceptors: | 5 |
| pro_donors: | 1 |
| pro_smile: | c1ccc(cc1)c2c(nnc(n2)SCC(=O)O)c3ccccc3 |
| InChi: | InChI=1S/C17H13N3O2S/c21-14(22)11-23-17-18-15(12-7-3-1-4-8-12)16(19-20-17)13-9-5-2-6-10-13/h1-10H,11H2,(H,21,22) |
| InChiKey: | InChIKey=ROQIGRLJUBETSG-UHFFFAOYSA-N |
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