EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C14H12N4O2S |
| Net Charge | 0 |
| Average Mass | 300.343 |
| Monoisotopic Mass | 300.06810 |
| SMILES | CC1=NN(c2ccccc2)C(=O)C1C=C1NC(=S)NC1=O |
| InChI | InChI=1S/C14H12N4O2S/c1-8-10(7-11-12(19)16-14(21)15-11)13(20)18(17-8)9-5-3-2-4-6-9/h2-7,10H,1H3,(H2,15,16,19,21) |
| InChIKey | UFKNVXBWMBITCM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-methyl-4-[(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-2-phenyl-4H-pyrazol-3-one (CHEBI:116874) has functional parent α-amino acid (CHEBI:33704) |
| 5-methyl-4-[(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-2-phenyl-4H-pyrazol-3-one (CHEBI:116874) is a organonitrogen compound (CHEBI:35352) |
| 5-methyl-4-[(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-2-phenyl-4H-pyrazol-3-one (CHEBI:116874) is a organooxygen compound (CHEBI:36963) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28325 | LINCS |