basic_info |
|
| Product_Name： | 香草磺胺 |
| CAS： | 119-85-7 |
| 中文同义词： | 香草磺胺 |
| EnglishSynonyms： | VANYLDISULFAMIDE |
| pro_mdlNumber： | MFCD00868357 |
| pro_acceptors： | 10 |
| pro_donors： | 5 |
| pro_smile： | COc1cc(ccc1O)C(Nc2ccc(cc2)S(=O)(=O)N)Nc3ccc(cc3)S(=O)(=O)N |
| InChi： | InChI=1S/C20H22N4O6S2/c1-30-19-12-13(2-11-18(19)25)20(23-14-3-7-16(8-4-14)31(21,26)27)24-15-5-9-17(10-6-15)32(22,28)29/h2-12,20,23-25H,1H3,(H2,21,26,27)(H2,22,28,29) |
| InChiKey： | InChIKey=XMLCDJOGFNNCSF-UHFFFAOYSA-N |
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