EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H18N4O2S |
| Net Charge | 0 |
| Average Mass | 414.490 |
| Monoisotopic Mass | 414.11505 |
| SMILES | Cn1c(SCC(=O)Nc2ccc3c(c2)oc2ccccc23)nnc1-c1ccccc1 |
| InChI | InChI=1S/C23H18N4O2S/c1-27-22(15-7-3-2-4-8-15)25-26-23(27)30-14-21(28)24-16-11-12-18-17-9-5-6-10-19(17)29-20(18)13-16/h2-13H,14H2,1H3,(H,24,28) |
| InChIKey | XSQXHRXJCIKADP-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(3-dibenzofuranyl)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide (CHEBI:114223) is a dibenzofurans (CHEBI:38922) |
| Manual Xrefs | Databases |
|---|---|
| LSM-25684 | LINCS |