EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H16N2O3S |
| Net Charge | 0 |
| Average Mass | 280.349 |
| Monoisotopic Mass | 280.08816 |
| SMILES | Cc1ccc(N2CS(=O)(=O)C(=CN(C)C)C2=O)cc1 |
| InChI | InChI=1S/C13H16N2O3S/c1-10-4-6-11(7-5-10)15-9-19(17,18)12(13(15)16)8-14(2)3/h4-8H,9H2,1-3H3 |
| InChIKey | BSQIADCBLJDKBB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(dimethylaminomethylidene)-3-(4-methylphenyl)-1,1-dioxo-1,3-thiazolidin-4-one (CHEBI:108010) is a toluenes (CHEBI:27024) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19387 | LINCS |