| SpectraBase Spectrum ID |
HI7Nfa2QmVR |
| Name |
7-(2,4-Dichloro-benzyl)-8-[2-(4-fluoro-benzyl)-2H-[1,2,4]triazol-3-ylsulfanyl]-1,3-dimethyl-3,7-dihydro-purine-2,6-dione |
| Alternate Name(s) |
7-(2,4-Dichlorobenzyl)-8-{[1-(4-fluorobenzyl)-1H-1,2,4-triazol-5-yl]sulfanyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H18Cl2FN7O2S |
| InChI |
InChI=1S/C23H18Cl2FN7O2S/c1-30-19-18(20(34)31(2)23(30)35)32(11-14-5-6-15(24)9-17(14)25)22(29-19)36-21-27-12-28-33(21)10-13-3-7-16(26)8-4-13/h3-9,12H,10-11H2,1-2H3 |
| InChIKey |
JFCHBNPVVSPIOD-UHFFFAOYSA-N |
| Molecular Weight |
546.408 g/mol |
| SMILES |
c12c([n](Cc3c(cc(cc3)Cl)Cl)c(n1)Sc1[n](ncn1)Cc1ccc(cc1)F)C(=O)N(C(N2C)=O)C |
| SPLASH |
splash10-0a4i-1902010000-83a64e34fa8d8c17d3f9 |
| Wiley ID |
1436723 |
![7-(2,4-Dichloro-benzyl)-8-[2-(4-fluoro-benzyl)-2H-[1,2,4]triazol-3-ylsulfanyl]-1,3-dimethyl-3,7-dihydro-purine-2,6-dione](/api/spectrum/HI7Nfa2QmVR/structure.png?h=300&w=458 "7-(2,4-Dichloro-benzyl)-8-[2-(4-fluoro-benzyl)-2H-[1,2,4]triazol-3-ylsulfanyl]-1,3-dimethyl-3,7-dihydro-purine-2,6-dione")
