EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H18ClNO3S |
| Net Charge | 0 |
| Average Mass | 351.855 |
| Monoisotopic Mass | 351.06959 |
| SMILES | CCOC(=O)c1c(C)nc(C(=O)CSc2ccc(Cl)cc2)c1C |
| InChI | InChI=1S/C17H18ClNO3S/c1-4-22-17(21)15-10(2)16(19-11(15)3)14(20)9-23-13-7-5-12(18)6-8-13/h5-8,19H,4,9H2,1-3H3 |
| InChIKey | OPXJWUMCOASDQH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-[2-[(4-chlorophenyl)thio]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester (CHEBI:107857) is a aryl sulfide (CHEBI:35683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19234 | LINCS |