basic_info |
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Product_Name: | 7-ALLYL-1,3-DIMETHYL-8-((4-METHYLBENZYL)THIO)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
EnglishSynonyms: | 7-ALLYL-1,3-DIMETHYL-8-((4-METHYLBENZYL)THIO)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
pro_mdlNumber: | MFCD02227434 |
pro_acceptors: | 6 |
pro_donors: | 0 |
pro_smile: | Cc1ccc(cc1)CSc2nc3c(n2CC=C)c(=O)n(c(=O)n3C)C |
InChi: | InChI=1S/C18H20N4O2S/c1-5-10-22-14-15(20(3)18(24)21(4)16(14)23)19-17(22)25-11-13-8-6-12(2)7-9-13/h5-9H,1,10-11H2,2-4H3 |
InChiKey: | InChIKey=PWYFJZPNVHBTBA-UHFFFAOYSA-N |
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