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CHEBI:116741 - 4-(4-methylphenyl)-2-[[3-(4-morpholinyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester
| Formula | C21H26N2O4S |
| Net Charge | 0 |
| Average Mass | 402.516 |
| Monoisotopic Mass | 402.16133 |
| SMILES | CCOC(=O)c1c(-c2ccc(C)cc2)csc1NC(=O)CCN1CCOCC1 |
| InChI | InChI=1S/C21H26N2O4S/c1-3-27-21(25)19-17(16-6-4-15(2)5-7-16)14-28-20(19)22-18(24)8-9-23-10-12-26-13-11-23/h4-7,14H,3,8-13H2,1-2H3,(H,22,24) |
| InChIKey | IVVTYJWBIJOMGI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-(4-methylphenyl)-2-[[3-(4-morpholinyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester (CHEBI:116741) has functional parent β-amino acid (CHEBI:33706) |
| 4-(4-methylphenyl)-2-[[3-(4-morpholinyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester (CHEBI:116741) is a organonitrogen compound (CHEBI:35352) |
| 4-(4-methylphenyl)-2-[[3-(4-morpholinyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester (CHEBI:116741) is a organooxygen compound (CHEBI:36963) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28193 | LINCS |