CHEBI:123418 - 2-[5-[(2-methoxyphenyl)methylidene]-3-[2-(4-morpholinyl)-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetic acid ethyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[5-[(2-methoxyphenyl)methylidene]-3-[2-(4-morpholinyl)-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetic acid ethyl ester
ChEBI ID CHEBI:123418
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H24N2O6S
Net Charge 0
Average Mass 432.492
Monoisotopic Mass 432.13551
InChI InChI=1S/C21H24N2O6S/c1-3-29-20(25)13-19-23(14-18(24)22-8-10-28-11-9-22)21(26)17(30-19)12-15-6-4-5-7-16(15)27-2/h4-7,12-13H,3,8-11,14H2,1-2H3
InChIKey PQNJBECFPBDTKM-UHFFFAOYSA-N
SMILES CCOC(=O)C=C1N(C(=O)C(=CC2=CC=CC=C2OC)S1)CC(=O)N3CCOCC3
ChEBI Ontology
Outgoing 2-[5-[(2-methoxyphenyl)methylidene]-3-[2-(4-morpholinyl)-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetic acid ethyl ester (CHEBI:123418) is a methoxybenzenes (CHEBI:51683)
Manual Xref Database
LSM-34860 LINCS
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