basic_info |
|
| Product_Name： | OTAVA-FLUOR OTVD_0252 |
| EnglishSynonyms： | OTAVA-FLUOR OTVD_0252 |
| pro_mdlNumber： | MFCD10001212 |
| pro_acceptors： | 2 |
| pro_donors： | 0 |
| pro_smile： | CC1=CC(=Cc2[n+](c3ccccc3s2)C)C=C(N1C)C.COS(=O)(=O)[O-] |
| InChi： | InChI=1S/C17H19N2S.CH4O4S/c1-12-9-14(10-13(2)18(12)3)11-17-19(4)15-7-5-6-8-16(15)20-17;1-5-6(2,3)4/h5-11H,1-4H3;1H3,(H,2,3,4)/q+1;/p-1 |
| InChiKey： | InChIKey=LAUQSKGLMNSOBK-UHFFFAOYSA-M |
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