EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H11ClF3N5OS |
| Net Charge | 0 |
| Average Mass | 437.834 |
| Monoisotopic Mass | 437.03249 |
| SMILES | COc1ccc(-c2ccnc3nc(Sc4ncc(C(F)(F)F)cc4Cl)nn23)cc1 |
| InChI | InChI=1S/C18H11ClF3N5OS/c1-28-12-4-2-10(3-5-12)14-6-7-23-16-25-17(26-27(14)16)29-15-13(19)8-11(9-24-15)18(20,21)22/h2-9H,1H3 |
| InChIKey | KIMKGQVCXHWZFA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine (CHEBI:107088) is a pyrimidines (CHEBI:39447) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18442 | LINCS |