EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H24N6O2S3 |
| Net Charge | 0 |
| Average Mass | 464.642 |
| Monoisotopic Mass | 464.11229 |
| SMILES | Cn1c(CSc2nc3ccccc3s2)nnc1SCC(=O)NCCN1CCOCC1 |
| InChI | InChI=1S/C19H24N6O2S3/c1-24-16(12-29-19-21-14-4-2-3-5-15(14)30-19)22-23-18(24)28-13-17(26)20-6-7-25-8-10-27-11-9-25/h2-5H,6-13H2,1H3,(H,20,26) |
| InChIKey | WNHHDFPAYMIDSZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[5-[(1,3-benzothiazol-2-ylthio)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-[2-(4-morpholinyl)ethyl]acetamide (CHEBI:120854) is a benzothiazoles (CHEBI:37947) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32297 | LINCS |