EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H16N4O3S |
| Net Charge | 0 |
| Average Mass | 344.396 |
| Monoisotopic Mass | 344.09431 |
| SMILES | O=C(Cn1nnc2sc3c(c2c1=O)CCCC3)NCc1ccco1 |
| InChI | InChI=1S/C16H16N4O3S/c21-13(17-8-10-4-3-7-23-10)9-20-16(22)14-11-5-1-2-6-12(11)24-15(14)18-19-20/h3-4,7H,1-2,5-6,8-9H2,(H,17,21) |
| InChIKey | IKNHZQAKBKLGMT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2-furanylmethyl)-2-(4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide (CHEBI:94096) is a triazines (CHEBI:38102) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4702 | LINCS |