EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H15N7S |
| Net Charge | 0 |
| Average Mass | 361.434 |
| Monoisotopic Mass | 361.11096 |
| SMILES | c1ccc(CCc2nn3c(Cn4nnc5ccccc54)nnc3s2)cc1 |
| InChI | InChI=1S/C18H15N7S/c1-2-6-13(7-3-1)10-11-17-22-25-16(20-21-18(25)26-17)12-24-15-9-5-4-8-14(15)19-23-24/h1-9H,10-12H2 |
| InChIKey | CRNJMJIRRMJGNJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(1-benzotriazolylmethyl)-6-(2-phenylethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CHEBI:120588) is a benzotriazoles (CHEBI:48912) |
| 3-(1-benzotriazolylmethyl)-6-(2-phenylethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CHEBI:120588) is a triazolothiadiazole (CHEBI:140920) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32031 | LINCS |