EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H17N3O4S |
| Net Charge | 0 |
| Average Mass | 371.418 |
| Monoisotopic Mass | 371.09398 |
| SMILES | COc1ccccc1NC(=O)CCSC1=NNC(=C2C=CC(=O)C=C2)O1 |
| InChI | InChI=1S/C18H17N3O4S/c1-24-15-5-3-2-4-14(15)19-16(23)10-11-26-18-21-20-17(25-18)12-6-8-13(22)9-7-12/h2-9,20H,10-11H2,1H3,(H,19,23) |
| InChIKey | FSPSCMPTPHAPAW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2-methoxyphenyl)-3-[[2-(4-oxo-1-cyclohexa-2,5-dienylidene)-3H-1,3,4-oxadiazol-5-yl]thio]propanamide (CHEBI:107359) is a anilide (CHEBI:13248) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18713 | LINCS |