EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:92078 - 4-chlorobenzoic acid [1-(2-thiazolyl)ethylideneamino] ester
| Formula | C12H9ClN2O2S |
| Net Charge | 0 |
| Average Mass | 280.736 |
| Monoisotopic Mass | 280.00733 |
| SMILES | CC(=NOC(=O)c1ccc(Cl)cc1)c1nccs1 |
| InChI | InChI=1S/C12H9ClN2O2S/c1-8(11-14-6-7-18-11)15-17-12(16)9-2-4-10(13)5-3-9/h2-7H,1H3 |
| InChIKey | KSHSYBSEZAKVGL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-chlorobenzoic acid [1-(2-thiazolyl)ethylideneamino] ester (CHEBI:92078) is a carbonyl compound (CHEBI:36586) |
| 4-chlorobenzoic acid [1-(2-thiazolyl)ethylideneamino] ester (CHEBI:92078) is a organohalogen compound (CHEBI:17792) |
| Manual Xrefs | Databases |
|---|---|
| LSM-2074 | LINCS |