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CHEBI:105818 - 4-[[1-oxo-2-(3-oxo-2-thiomorpholinyl)ethyl]amino]benzoic acid ethyl ester

ChEBI IDCHEBI:105818
ChEBI Name4-[[1-oxo-2-(3-oxo-2-thiomorpholinyl)ethyl]amino]benzoic acid ethyl ester
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DownloadsMolfile
FormulaC15H18N2O4S
Net Charge0
Average Mass322.386
Monoisotopic Mass322.09873
SMILESCCOC(=O)c1ccc(NC(=O)CC2SCCNC2=O)cc1
InChIInChI=1S/C15H18N2O4S/c1-2-21-15(20)10-3-5-11(6-4-10)17-13(18)9-12-14(19)16-7-8-22-12/h3-6,12H,2,7-9H2,1H3,(H,16,19)(H,17,18)
InChIKeyFZNMSKOVKJFGGH-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-[[1-oxo-2-(3-oxo-2-thiomorpholinyl)ethyl]amino]benzoic acid ethyl ester (CHEBI:105818) is a amidobenzoic acid (CHEBI:48470)
Manual XrefsDatabases
LSM-17179LINCS