EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H14N2O2S |
| Net Charge | 0 |
| Average Mass | 250.323 |
| Monoisotopic Mass | 250.07760 |
| SMILES | Cc1ccccc1OCC(=O)NC1=NCCS1 |
| InChI | InChI=1S/C12H14N2O2S/c1-9-4-2-3-5-10(9)16-8-11(15)14-12-13-6-7-17-12/h2-5H,6-8H2,1H3,(H,13,14,15) |
| InChIKey | VTDBLIGOEROGEY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(4,5-dihydrothiazol-2-yl)-2-(2-methylphenoxy)acetamide (CHEBI:115687) is a aromatic ether (CHEBI:35618) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27144 | LINCS |