EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C23H16N2O3S |
| Net Charge | 0 |
| Average Mass | 400.459 |
| Monoisotopic Mass | 400.08816 |
| SMILES | O=C(OCC#CCSc1nnc(-c2cccc3ccccc23)o1)c1ccccc1 |
| InChI | InChI=1S/C23H16N2O3S/c26-22(18-10-2-1-3-11-18)27-15-6-7-16-29-23-25-24-21(28-23)20-14-8-12-17-9-4-5-13-19(17)20/h1-5,8-14H,15-16H2 |
| InChIKey | ZANDCCMLBMLTSB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| benzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester (CHEBI:93280) is a naphthalenes (CHEBI:25477) |
| Manual Xrefs | Databases |
|---|---|
| LSM-3631 | LINCS |