CHEBI:111363 - 2-[3-[2-[2-(difluoromethoxy)anilino]-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetic acid ethyl ester

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ChEBI Name 2-[3-[2-[2-(difluoromethoxy)anilino]-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetic acid ethyl ester
ChEBI ID CHEBI:111363
Stars This entity has been manually annotated by a third party.
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Formula C16H16F2N2O5S
Net Charge 0
Average Mass 386.372
Monoisotopic Mass 386.07480
InChI InChI=1S/C16H16F2N2O5S/c1-2-24-15(23)7-14-20(13(22)9-26-14)8-12(21)19-10-5-3-4-6-11(10)25-16(17)18/h3-7,16H,2,8-9H2,1H3,(H,19,21)
InChIKey PSEUNLFDCXCPRW-UHFFFAOYSA-N
SMILES CCOC(=O)C=C1N(C(=O)CS1)CC(=O)NC2=CC=CC=C2OC(F)F
ChEBI Ontology
Outgoing 2-[3-[2-[2-(difluoromethoxy)anilino]-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetic acid ethyl ester (CHEBI:111363) has functional parent α-amino acid (CHEBI:33704)
2-[3-[2-[2-(difluoromethoxy)anilino]-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetic acid ethyl ester (CHEBI:111363) is a organonitrogen compound (CHEBI:35352)
2-[3-[2-[2-(difluoromethoxy)anilino]-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetic acid ethyl ester (CHEBI:111363) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
LSM-22819 LINCS
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