EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H20N4O3S3 |
| Net Charge | 0 |
| Average Mass | 448.595 |
| Monoisotopic Mass | 448.06975 |
| SMILES | CCSc1nnc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccc(C)cc3)c2)s1 |
| InChI | InChI=1S/C19H20N4O3S3/c1-4-27-19-22-21-18(28-19)20-17(24)14-6-5-7-16(12-14)29(25,26)23(3)15-10-8-13(2)9-11-15/h5-12H,4H2,1-3H3,(H,20,21,24) |
| InChIKey | ZHXMHIXLYABNRL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide (CHEBI:119877) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31321 | LINCS |