EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H14N2O2S |
| Net Charge | 0 |
| Average Mass | 310.378 |
| Monoisotopic Mass | 310.07760 |
| SMILES | C=C1c2cc3c(cc2NC(=S)N1Cc1ccccc1)OCO3 |
| InChI | InChI=1S/C17H14N2O2S/c1-11-13-7-15-16(21-10-20-15)8-14(13)18-17(22)19(11)9-12-5-3-2-4-6-12/h2-8H,1,9-10H2,(H,18,22) |
| InChIKey | TYWJRVSGRQNHTN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 8-methylene-7-(phenylmethyl)-5H-[1,3]dioxolo[4,5-g]quinazoline-6-thione (CHEBI:109258) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20655 | LINCS |