EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H12N4S |
| Net Charge | 0 |
| Average Mass | 292.367 |
| Monoisotopic Mass | 292.07827 |
| SMILES | S=c1nnc2c3ccccc3n(Cc3ccccc3)c2n1 |
| InChI | InChI=1S/C16H12N4S/c21-16-17-15-14(18-19-16)12-8-4-5-9-13(12)20(15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,17,19,21) |
| InChIKey | CMWAFGJNLNZSMR-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(phenylmethyl)-2H-[1,2,4]triazino[5,6-b]indole-3-thione (CHEBI:94025) is a triazinoindole (CHEBI:142677) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4619 | LINCS |