EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H15N3O2S2 |
| Net Charge | 0 |
| Average Mass | 309.416 |
| Monoisotopic Mass | 309.06057 |
| SMILES | CCOCc1nnc(NC(=O)CSc2ccccc2)s1 |
| InChI | InChI=1S/C13H15N3O2S2/c1-2-18-8-12-15-16-13(20-12)14-11(17)9-19-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,16,17) |
| InChIKey | CEAQUIJPGSBKQW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(phenylthio)acetamide (CHEBI:105645) is a aromatic amide (CHEBI:62733) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17008 | LINCS |