EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H16N2S |
| Net Charge | 0 |
| Average Mass | 244.363 |
| Monoisotopic Mass | 244.10342 |
| SMILES | Cc1cc(C)c(C)c(C=C(C#N)C(N)=S)c1C |
| InChI | InChI=1S/C14H16N2S/c1-8-5-9(2)11(4)13(10(8)3)6-12(7-15)14(16)17/h5-6H,1-4H3,(H2,16,17) |
| InChIKey | DKMNDHCKWPIRJA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-cyano-3-(2,3,5,6-tetramethylphenyl)-2-propenethioamide (CHEBI:116477) is a benzenes (CHEBI:22712) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27931 | LINCS |