basic_info |
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| Product_Name: | 7-[2-(1H-BENZIMIDAZOL-2-YLSULFANYL)ETHYL]-8-(4-BENZYL-1-PIPERAZINYL)-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| CAS: | 476482-41-4 |
| EnglishSynonyms: | 7-[2-(1H-BENZIMIDAZOL-2-YLSULFANYL)ETHYL]-8-(4-BENZYL-1-PIPERAZINYL)-3-METHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD03668993 |
| pro_acceptors: | 10 |
| pro_donors: | 2 |
| pro_smile: | Cn1c2c(c(=O)[nH]c1=O)n(c(n2)N3CCN(CC3)Cc4ccccc4)CCSc5[nH]c6ccccc6n5 |
| InChi: | InChI=1S/C26H28N8O2S/c1-31-22-21(23(35)30-26(31)36)34(15-16-37-24-27-19-9-5-6-10-20(19)28-24)25(29-22)33-13-11-32(12-14-33)17-18-7-3-2-4-8-18/h2-10H,11-17H2,1H3,(H,27,28)(H,30,35,36) |
| InChiKey: | InChIKey=AJPGHZCUNUOXIE-UHFFFAOYSA-N |
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