basic_info |
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| Product_Name: | 8-(BENZYLTHIO)-1,3-DIMETHYL-7-(3-PHENYLPROPYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| EnglishSynonyms: | 8-(BENZYLTHIO)-1,3-DIMETHYL-7-(3-PHENYLPROPYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD02983153 |
| pro_acceptors: | 6 |
| pro_donors: | 0 |
| pro_smile: | Cn1c2c(c(=O)n(c1=O)C)n(c(n2)SCc3ccccc3)CCCc4ccccc4 |
| InChi: | InChI=1S/C23H24N4O2S/c1-25-20-19(21(28)26(2)23(25)29)27(15-9-14-17-10-5-3-6-11-17)22(24-20)30-16-18-12-7-4-8-13-18/h3-8,10-13H,9,14-16H2,1-2H3 |
| InChiKey: | InChIKey=DMJMSGZNTFQSQD-UHFFFAOYSA-N |
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