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CHEBI:228777 - ethyl 2-cyano-3-[2-(methylthio)anilino]acrylate
| Formula | C13H14N2O2S |
| Net Charge | 0 |
| Average Mass | 262.334 |
| Monoisotopic Mass | 262.07760 |
| SMILES | CCOC(=O)C(C#N)=CNc1ccccc1SC |
| InChI | InChI=1S/C13H14N2O2S/c1-3-17-13(16)10(8-14)9-15-11-6-4-5-7-12(11)18-2/h4-7,9,15H,3H2,1-2H3 |
| InChIKey | YGERPPOHUUISMQ-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | urine (BTO:0001419) | MetaboLights (MTBLS8662) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| ethyl 2-cyano-3-[2-(methylthio)anilino]acrylate (CHEBI:228777) is a aryl sulfide (CHEBI:35683) |
| IUPAC Name |
|---|
| ethyl 2-cyano-3-(2-methylsulanylanilino)prop-2-enoate |
| Manual Xrefs | Databases |
|---|---|
| 2670175 | ChemSpider |