basic_info |
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| Product_Name: | 7-(4-CHLOROBENZYL)-1,3-DIMETHYL-8-[(4-NITROBENZYL)SULFANYL]-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| EnglishSynonyms: | 7-(4-CHLOROBENZYL)-1,3-DIMETHYL-8-[(4-NITROBENZYL)SULFANYL]-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD03417539 |
| pro_acceptors: | 9 |
| pro_donors: | 0 |
| pro_smile: | Cn1c2c(c(=O)n(c1=O)C)n(c(n2)SCc3ccc(cc3)[N+](=O)[O-])Cc4ccc(cc4)Cl |
| InChi: | InChI=1S/C21H18ClN5O4S/c1-24-18-17(19(28)25(2)21(24)29)26(11-13-3-7-15(22)8-4-13)20(23-18)32-12-14-5-9-16(10-6-14)27(30)31/h3-10H,11-12H2,1-2H3 |
| InChiKey: | InChIKey=UYPXXSZRHRDXDZ-UHFFFAOYSA-N |
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