basic_info |
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Product_Name: | PENTYL 2-((3,5-DIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZIN-6-YL)THIO)BUTANOATE |
EnglishSynonyms: | PENTYL 2-((3,5-DIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZIN-6-YL)THIO)BUTANOATE |
pro_mdlNumber: | MFCD01463144 |
pro_acceptors: | 7 |
pro_donors: | 2 |
pro_smile: | CCCCCOC(=O)C(CC)Sc1c(=O)[nH]c(=O)[nH]n1 |
InChi: | InChI=1S/C12H19N3O4S/c1-3-5-6-7-19-11(17)8(4-2)20-10-9(16)13-12(18)15-14-10/h8H,3-7H2,1-2H3,(H2,13,15,16,18) |
InChiKey: | InChIKey=CDTPCQIIDWZHNJ-UHFFFAOYSA-N |
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