basic_info |
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| Product_Name: | 1-(3,5-DIMETHYL-1H-4-PYRAZOLYL)-3-BUTANONE THIOSEMICARBAZONE THIOCYANATE |
| CAS: | 10514-39-3 |
| EnglishSynonyms: | 1-(3,5-DIMETHYL-1H-4-PYRAZOLYL)-3-BUTANONE THIOSEMICARBAZONE THIOCYANATE |
| pro_mdlNumber: | MFCD01656275 |
| pro_acceptors: | 5 |
| pro_donors: | 3 |
| pro_smile: | Cc1c(c(n[nH]1)C)CC/C(=N/NC(=S)N)/C.C(#N)S |
| InChi: | InChI=1S/C10H17N5S.CHNS/c1-6(12-15-10(11)16)4-5-9-7(2)13-14-8(9)3;2-1-3/h4-5H2,1-3H3,(H,13,14)(H3,11,15,16);3H/b12-6+; |
| InChiKey: | InChIKey=AGHHLQDXNMTECB-WXIWBVQFSA-N |
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