EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C23H18N4O5S |
| Net Charge | 0 |
| Average Mass | 462.487 |
| Monoisotopic Mass | 462.09979 |
| SMILES | COc1ccc(C(=O)Nn2c(SCc3ccc([N+](=O)[O-])cc3)nc3ccccc3c2=O)cc1 |
| InChI | InChI=1S/C23H18N4O5S/c1-32-18-12-8-16(9-13-18)21(28)25-26-22(29)19-4-2-3-5-20(19)24-23(26)33-14-15-6-10-17(11-7-15)27(30)31/h2-13H,14H2,1H3,(H,25,28) |
| InChIKey | LNHHUUBVHBPJRG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-methoxy-N-[2-[(4-nitrophenyl)methylthio]-4-oxo-3-quinazolinyl]benzamide (CHEBI:105747) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17109 | LINCS |