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CHEBI:116253 - 2-[(4-cyano-1-oxo-5H-pyrido[1,2-a]benzimidazol-3-yl)methylthio]propanoic acid
| Formula | C16H13N3O3S |
| Net Charge | 0 |
| Average Mass | 327.365 |
| Monoisotopic Mass | 327.06776 |
| SMILES | CC(SCc1cc(=O)n2c(nc3ccccc32)c1C#N)C(=O)O |
| InChI | InChI=1S/C16H13N3O3S/c1-9(16(21)22)23-8-10-6-14(20)19-13-5-3-2-4-12(13)18-15(19)11(10)7-17/h2-6,9,18H,8H2,1H3,(H,21,22) |
| InChIKey | GULQCZYYKHCNEZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(4-cyano-1-oxo-5H-pyrido[1,2-a]benzimidazol-3-yl)methylthio]propanoic acid (CHEBI:116253) is a benzimidazoles (CHEBI:22715) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27708 | LINCS |