EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:113191 - 2-cyano-3-(4-ethylphenyl)-2-propenethioamide
| Formula | C12H12N2S |
| Net Charge | 0 |
| Average Mass | 216.309 |
| Monoisotopic Mass | 216.07212 |
| SMILES | CCc1ccc(C=C(C#N)C(N)=S)cc1 |
| InChI | InChI=1S/C12H12N2S/c1-2-9-3-5-10(6-4-9)7-11(8-13)12(14)15/h3-7H,2H2,1H3,(H2,14,15) |
| InChIKey | SGVLLSTVURBKHH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-cyano-3-(4-ethylphenyl)-2-propenethioamide (CHEBI:113191) is a benzenes (CHEBI:22712) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24602 | LINCS |