EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H19NO3S |
| Net Charge | 0 |
| Average Mass | 353.443 |
| Monoisotopic Mass | 353.10856 |
| SMILES | CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)C1=Cc1cccs1 |
| InChI | InChI=1S/C20H19NO3S/c1-4-24-20(23)18-14(3)21(15-9-7-13(2)8-10-15)19(22)17(18)12-16-6-5-11-25-16/h5-12H,4H2,1-3H3 |
| InChIKey | HQEVAWZHUQQXMP-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-methyl-1-(4-methylphenyl)-5-oxo-4-(thiophen-2-ylmethylidene)-3-pyrrolecarboxylic acid ethyl ester (CHEBI:114219) is a pyrroline (CHEBI:23763) |
| Manual Xrefs | Databases |
|---|---|
| LSM-25680 | LINCS |