basic_info |
|
| Product_Name： | BUTABINDIDE |
| CAS： | 175553-48-7 |
| EnglishSynonyms： | BUTABINDIDE |
| pro_mdlNumber： | MFCD00867158 |
| pro_acceptors： | 5 |
| pro_donors： | 2 |
| pro_smile： | CCCCNC(=O)[C@@H]1Cc2ccccc2N1C(=O)[C@H](CC)N |
| InChi： | InChI=1S/C17H25N3O2/c1-3-5-10-19-16(21)15-11-12-8-6-7-9-14(12)20(15)17(22)13(18)4-2/h6-9,13,15H,3-5,10-11,18H2,1-2H3,(H,19,21)/t13-,15-/m0/s1 |
| InChiKey： | InChIKey=HAQIRIMIVLFYIX-ZFWWWQNUSA-N |
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