Basic Information |
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| Product Name: | 3-ETHYL-1-PROPYL-8-(1-(3-(TRIFLUOROMETHYL)BENZYL)-1H-PYRAZOL-4-YL)-1H-PURINE-2,6(3H,8H)-DIONE |
| CAS: | 752222-83-6 |
| English Synonyms: | 3-ETHYL-1-PROPYL-8-(1-(3-(TRIFLUOROMETHYL)BENZYL)-1H-PYRAZOL-4-YL)-1H-PURINE-2,6(3H,8H)-DIONE ; 3-ETHYL-1-PROPYL-8-(1-[3-(TRIFLUOROMETHYL)BENZYL]-1H-PYRAZOL-4-YL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| MDL Number.: | MFCD11042420 |
| H bond acceptor: | 8 |
| H bond donor: | 1 |
| Smile: | CCCn1c(=O)c2c(nc([nH]2)c3cnn(c3)Cc4cccc(c4)C(F)(F)F)n(c1=O)CC |
| InChi: | InChI=1S/C21H21F3N6O2/c1-3-8-30-19(31)16-18(29(4-2)20(30)32)27-17(26-16)14-10-25-28(12-14)11-13-6-5-7-15(9-13)21(22,23)24/h5-7,9-10,12H,3-4,8,11H2,1-2H3,(H,26,27) |
| InChiKey: | InChIKey=KOYXXLLNCXWUNF-UHFFFAOYSA-N |
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