EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H18N4O2S3 |
| Net Charge | 0 |
| Average Mass | 430.580 |
| Monoisotopic Mass | 430.05919 |
| SMILES | CC1Cc2ccccc2N1C(=O)CSc1nnc(NC(=O)Cc2cccs2)s1 |
| InChI | InChI=1S/C19H18N4O2S3/c1-12-9-13-5-2-3-7-15(13)23(12)17(25)11-27-19-22-21-18(28-19)20-16(24)10-14-6-4-8-26-14/h2-8,12H,9-11H2,1H3,(H,20,21,24) |
| InChIKey | PSLMFSOEBNFDQW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[5-[[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-2-thiophen-2-ylacetamide (CHEBI:107358) is a indoles (CHEBI:24828) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18712 | LINCS |