EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H25N5O4S2 |
| Net Charge | 0 |
| Average Mass | 487.607 |
| Monoisotopic Mass | 487.13480 |
| SMILES | Cc1ccc(NC(=O)CSc2nnc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2C)cc1 |
| InChI | InChI=1S/C22H25N5O4S2/c1-16-3-7-18(8-4-16)23-20(28)15-32-22-25-24-21(26(22)2)17-5-9-19(10-6-17)33(29,30)27-11-13-31-14-12-27/h3-10H,11-15H2,1-2H3,(H,23,28) |
| InChIKey | APNFYXCQUWJYBP-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[4-methyl-5-[4-(4-morpholinylsulfonyl)phenyl]-1,2,4-triazol-3-yl]thio]-N-(4-methylphenyl)acetamide (CHEBI:112924) is a triazoles (CHEBI:35727) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24334 | LINCS |