EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H14N2O2S |
| Net Charge | 0 |
| Average Mass | 298.367 |
| Monoisotopic Mass | 298.07760 |
| SMILES | COc1cccc(Nc2nc(-c3ccc(O)cc3)cs2)c1 |
| InChI | InChI=1S/C16H14N2O2S/c1-20-14-4-2-3-12(9-14)17-16-18-15(10-21-16)11-5-7-13(19)8-6-11/h2-10,19H,1H3,(H,17,18) |
| InChIKey | IFCQEPWFSBLITN-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[2-(3-methoxyanilino)-4-thiazolyl]phenol (CHEBI:119903) is a methoxybenzenes (CHEBI:51683) |
| 4-[2-(3-methoxyanilino)-4-thiazolyl]phenol (CHEBI:119903) is a substituted aniline (CHEBI:48975) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31347 | LINCS |