EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H9ClN4OS |
| Net Charge | 0 |
| Average Mass | 292.751 |
| Monoisotopic Mass | 292.01856 |
| SMILES | O=C(NC(=S)Nc1ncccn1)c1ccccc1Cl |
| InChI | InChI=1S/C12H9ClN4OS/c13-9-5-2-1-4-8(9)10(18)16-12(19)17-11-14-6-3-7-15-11/h1-7H,(H2,14,15,16,17,18,19) |
| InChIKey | RSNZPYJRZFRPCZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-chloro-N-[(2-pyrimidinylamino)-sulfanylidenemethyl]benzamide (CHEBI:107943) is a carbonyl compound (CHEBI:36586) |
| 2-chloro-N-[(2-pyrimidinylamino)-sulfanylidenemethyl]benzamide (CHEBI:107943) is a organohalogen compound (CHEBI:17792) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19320 | LINCS |