EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C7H10N2O2S3 |
| Net Charge | 0 |
| Average Mass | 250.370 |
| Monoisotopic Mass | 249.99044 |
| SMILES | CCOC(=O)CCSc1nnc(=S)s1 |
| InChI | InChI=1S/C7H10N2O2S3/c1-2-11-5(10)3-4-13-7-9-8-6(12)14-7/h2-4H2,1H3,(H,8,12) |
| InChIKey | DFJAVYMZVVHEDE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]propanoic acid ethyl ester (CHEBI:94049) is a aryl sulfide (CHEBI:35683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4648 | LINCS |