basic_info |
|
| Product_Name： | AURORA 22338 |
| EnglishSynonyms： | AURORA 22338 |
| pro_mdlNumber： | MFCD04064725 |
| pro_acceptors： | 6 |
| pro_donors： | 1 |
| pro_smile： | CCCCOC(=O)C1=C(C)NC2=NC=NN2C1C1=CC=C(Cl)C=C1 |
| InChi： | InChI=1S/C17H19ClN4O2/c1-3-4-9-24-16(23)14-11(2)21-17-19-10-20-22(17)15(14)12-5-7-13(18)8-6-12/h5-8,10,15H,3-4,9H2,1-2H3,(H,19,20,21) |
| InChiKey： | InChIKey=KERCAOUCXQDRDH-UHFFFAOYSA-N |
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