| SpectraBase Spectrum ID |
4tNMDfmTQyX |
| Name |
7-(2-fluorobenzyl)-1,3-dimethyl-8-(2H-tetrazol-5-ylmethylthio)xanthine |
| Alternate Name(s) |
7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-(2H-1,2,3,4-tetrazol-5-ylmethylsulfanyl)purine-2,6-dione
7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-(2H-tetrazol-5-ylmethylsulfanyl)purine-2,6-dione
7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-(2H-tetrazol-5-ylmethylthio)purine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15FN8O2S |
| InChI |
InChI=1S/C16H15FN8O2S/c1-23-13-12(14(26)24(2)16(23)27)25(7-9-5-3-4-6-10(9)17)15(18-13)28-8-11-19-21-22-20-11/h3-6H,7-8H2,1-2H3,(H,19,20,21,22) |
| InChIKey |
UKXIMEWADWSRQX-UHFFFAOYSA-N |
| Molecular Weight |
402.408 g/mol |
| SMILES |
[nH]1nnnc1CSc1nc2N(C(=O)N(C(c2[n]1Cc1ccccc1F)=O)C)C |
| SPLASH |
splash10-0a4i-5921100000-6003aa4a475b91355666 |
| Wiley ID |
1512173 |
