EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H21N3O2S2 |
| Net Charge | 0 |
| Average Mass | 459.596 |
| Monoisotopic Mass | 459.10752 |
| SMILES | Cc1ccc(C(=O)Nc2ccccc2SCC2CSc3nc4ccccc4c(=O)n32)cc1 |
| InChI | InChI=1S/C25H21N3O2S2/c1-16-10-12-17(13-11-16)23(29)26-21-8-4-5-9-22(21)31-14-18-15-32-25-27-20-7-3-2-6-19(20)24(30)28(18)25/h2-13,18H,14-15H2,1H3,(H,26,29) |
| InChIKey | XFTXNXNDSSZOSJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-methyl-N-[2-[(5-oxo-2,3-dihydrothiazolo[2,3-b]quinazolin-3-yl)methylthio]phenyl]benzamide (CHEBI:108268) is a benzamides (CHEBI:22702) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19645 | LINCS |