| SpectraBase Spectrum ID |
7ifGJzkC46G |
| Name |
1,3-Dimethyl-6-thioxo-1,3,6,7-tetrahydro-2H-purin-2-one |
| CAS Registry Number |
2398-70-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H8N4OS |
| InChI |
InChI=1S/C7H8N4OS/c1-10-5-4(8-3-9-5)6(13)11(2)7(10)12/h3H,1-2H3,(H,8,9) |
| InChIKey |
FDDCBLYAEALGPZ-UHFFFAOYSA-N |
| Molecular Weight |
196.228 g/mol |
| SMILES |
[nH]1cnc2N(C(N(C(c12)=S)C)=O)C |
| SPLASH |
splash10-0002-0900000000-ea4f643b59bc34f5f860 |
| Source of Spectrum |
NP-3-8426-0 |
| Synonyms |
6-Thiotheophylline
1,3-Dimethyl-6-sulfanylidene-7H-purin-2-one |
| Wiley ID |
1103262 |
