EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H16N4O3S |
| Net Charge | 0 |
| Average Mass | 332.385 |
| Monoisotopic Mass | 332.09431 |
| SMILES | COC1=CC(=CNNC(=S)Nc2cccnc2)C=C(OC)C1=O |
| InChI | InChI=1S/C15H16N4O3S/c1-21-12-6-10(7-13(22-2)14(12)20)8-17-19-15(23)18-11-4-3-5-16-9-11/h3-9,17H,1-2H3,(H2,18,19,23) |
| InChIKey | CZKSQDNCKKSSOW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-(3-pyridinyl)thiourea (CHEBI:107289) is a quinomethanes (CHEBI:52404) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18643 | LINCS |