EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H23ClN2O2S |
| Net Charge | 0 |
| Average Mass | 378.925 |
| Monoisotopic Mass | 378.11688 |
| SMILES | CCCCCCCCSC(=O)Oc1cc(Cl)nnc1-c1ccccc1 |
| InChI | InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3 |
| InChIKey | JTZCTMAVMHRNTR-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pyridate (CHEBI:81971) is a pyridazines (CHEBI:37921) |