EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H12N2O2S |
| Net Charge | 0 |
| Average Mass | 236.296 |
| Monoisotopic Mass | 236.06195 |
| SMILES | CCSc1nnc(-c2ccc(OC)cc2)o1 |
| InChI | InChI=1S/C11H12N2O2S/c1-3-16-11-13-12-10(15-11)8-4-6-9(14-2)7-5-8/h4-7H,3H2,1-2H3 |
| InChIKey | RWIXHUVOMHDDPG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(ethylthio)-5-(4-methoxyphenyl)-1,3,4-oxadiazole (CHEBI:109281) is a methoxybenzenes (CHEBI:51683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20678 | LINCS |