basic_info |
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Product_Name: | 2-[(4-BUTYL-5-METHYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETIC ACID |
EnglishSynonyms: | 2-[(4-BUTYL-5-METHYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETIC ACID |
pro_mdlNumber: | MFCD11203412 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | CCCCn1c(nnc1SCC(=O)O)C |
InChi: | InChI=1S/C9H15N3O2S/c1-3-4-5-12-7(2)10-11-9(12)15-6-8(13)14/h3-6H2,1-2H3,(H,13,14) |
InChiKey: | InChIKey=SJTQTYJIMPMXDS-UHFFFAOYSA-N |
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