EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H20ClN3O2S2 |
| Net Charge | 0 |
| Average Mass | 421.975 |
| Monoisotopic Mass | 421.06855 |
| SMILES | COCCn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)NCc1cccs1 |
| InChI | InChI=1S/C19H20ClN3O2S2/c1-25-9-8-23-17(14-4-6-15(20)7-5-14)12-22-19(23)27-13-18(24)21-11-16-3-2-10-26-16/h2-7,10,12H,8-9,11,13H2,1H3,(H,21,24) |
| InChIKey | JRFAGZKNWDXQOA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[5-(4-chlorophenyl)-1-(2-methoxyethyl)-2-imidazolyl]thio]-N-(thiophen-2-ylmethyl)acetamide (CHEBI:120818) is a imidazoles (CHEBI:24780) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32261 | LINCS |