EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H25N3O3S2 |
| Net Charge | 0 |
| Average Mass | 479.627 |
| Monoisotopic Mass | 479.13373 |
| SMILES | CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)cc1 |
| InChI | InChI=1S/C25H25N3O3S2/c1-25(2,3)18-10-14-20(15-11-18)33(30,31)26-16-23(29)27-19-12-8-17(9-13-19)24-28-21-6-4-5-7-22(21)32-24/h4-15,26H,16H2,1-3H3,(H,27,29) |
| InChIKey | HHDBLIDNWXQHFD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-tert-butylphenyl)sulfonylamino]acetamide (CHEBI:112218) is a amino acid amide (CHEBI:22475) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23630 | LINCS |