EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H13ClN2O2S |
| Net Charge | 0 |
| Average Mass | 332.812 |
| Monoisotopic Mass | 332.03863 |
| SMILES | Cc1sc(=NC(=O)c2ccco2)n(C)c1-c1ccc(Cl)cc1 |
| InChI | InChI=1S/C16H13ClN2O2S/c1-10-14(11-5-7-12(17)8-6-11)19(2)16(22-10)18-15(20)13-4-3-9-21-13/h3-9H,1-2H3 |
| InChIKey | HLDNTBDDSZYDMO-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[4-(4-chlorophenyl)-3,5-dimethyl-2-thiazolylidene]-2-furancarboxamide (CHEBI:105089) is a furoic acid (CHEBI:36055) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16452 | LINCS |