EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H16N4OS |
| Net Charge | 0 |
| Average Mass | 324.409 |
| Monoisotopic Mass | 324.10448 |
| SMILES | N#CC1=C(N)Oc2nnc(-c3cccs3)c2C1C1C=CCCC1 |
| InChI | InChI=1S/C17H16N4OS/c18-9-11-13(10-5-2-1-3-6-10)14-15(12-7-4-8-23-12)20-21-17(14)22-16(11)19/h2,4-5,7-8,10,13H,1,3,6,19H2,(H,20,21) |
| InChIKey | CSUSGCVWHUAESF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-amino-4-(1-cyclohex-2-enyl)-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile (CHEBI:123335) is a pyranopyrazole (CHEBI:131903) |
| Manual Xrefs | Databases |
|---|---|
| LSM-34778 | LINCS |