| SpectraBase Spectrum ID |
8jX2iqwqBIy |
| Name |
8-(4-tert-butylphenoxy)-7-(2-chlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Alternate Name(s) |
8-(4-tert-butylphenoxy)-7-(2-chlorobenzyl)-1,3-dimethyl-xanthine
8-(4-tert-butylphenoxy)-7-[(2-chlorophenyl)methyl]-1,3-dimethyl-purine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H25ClN4O3 |
| InChI |
InChI=1S/C24H25ClN4O3/c1-24(2,3)16-10-12-17(13-11-16)32-22-26-20-19(21(30)28(5)23(31)27(20)4)29(22)14-15-8-6-7-9-18(15)25/h6-13H,14H2,1-5H3 |
| InChIKey |
NMUWTZHPQKZTGA-UHFFFAOYSA-N |
| Molecular Weight |
452.942 g/mol |
| SMILES |
c12c([n](Cc3c(Cl)cccc3)c(n1)Oc1ccc(C(C)(C)C)cc1)C(=O)N(C(N2C)=O)C |
| SPLASH |
splash10-0a7i-9850200000-e4175496a965cfd8ebef |
| Wiley ID |
1460930 |
