basic_info |
|
| Product_Name： | BUTTPARK 23\07-85 |
| EnglishSynonyms： | BUTTPARK 23\07-85 |
| pro_mdlNumber： | MFCD01569468 |
| pro_acceptors： | 8 |
| pro_donors： | 0 |
| pro_smile： | c1ccc(cc1)c2c(=O)n3c(nn2)SCC(=N3)c4ccc(cc4)[N+](=O)[O-] |
| InChi： | InChI=1S/C17H11N5O3S/c23-16-15(12-4-2-1-3-5-12)18-19-17-21(16)20-14(10-26-17)11-6-8-13(9-7-11)22(24)25/h1-9H,10H2 |
| InChiKey： | InChIKey=QOCNHMOCFIYUOB-UHFFFAOYSA-N |
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