EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H23N5O3S3 |
| Net Charge | 0 |
| Average Mass | 477.637 |
| Monoisotopic Mass | 477.09630 |
| SMILES | CCn1c(SCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)nnc1-c1cccs1 |
| InChI | InChI=1S/C20H23N5O3S3/c1-2-25-19(17-9-6-14-29-17)21-22-20(25)30-15-18(26)23-10-12-24(13-11-23)31(27,28)16-7-4-3-5-8-16/h3-9,14H,2,10-13,15H2,1H3 |
| InChIKey | KCJOEEKCOVYHCV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]ethanone (CHEBI:121680) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33123 | LINCS |