basic_info |
|
| Product_Name： | AURORA 3998 |
| EnglishSynonyms： | AURORA 3998 |
| pro_mdlNumber： | MFCD01180721 |
| pro_acceptors： | 6 |
| pro_donors： | 1 |
| pro_smile： | OC1=CC=C(\C=C2/SC(=S)N(C2=O)C2=CC(Cl)=CC=C2)C=C1[N+]([O-])=O |
| InChi： | InChI=1S/C16H9ClN2O4S2/c17-10-2-1-3-11(8-10)18-15(21)14(25-16(18)24)7-9-4-5-13(20)12(6-9)19(22)23/h1-8,20H/b14-7- |
| InChiKey： | InChIKey=GRAFEKNCSDWHFX-AUWJEWJLSA-N |
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