EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H17N5O3S3 |
| Net Charge | 0 |
| Average Mass | 447.567 |
| Monoisotopic Mass | 447.04935 |
| SMILES | CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccccc3)cc2)s1 |
| InChI | InChI=1S/C18H17N5O3S3/c1-2-15-21-22-18(28-15)23-29(25,26)14-10-8-13(9-11-14)19-17(27)20-16(24)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H,22,23)(H2,19,20,24,27) |
| InChIKey | CMSYHNSRNXLHDZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]anilino]-sulfanylidenemethyl]benzamide (CHEBI:121550) is a thioureas (CHEBI:51276) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32993 | LINCS |