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CHEBI:111463 - 5-acetyl-2-[[[2-[(2-ethoxyphenyl)methylidene]hydrazinyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester

ChEBI IDCHEBI:111463
ChEBI Name5-acetyl-2-[[[2-[(2-ethoxyphenyl)methylidene]hydrazinyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester
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DownloadsMolfile
FormulaC20H23N3O5S
Net Charge0
Average Mass417.487
Monoisotopic Mass417.13584
SMILESCCOC(=O)c1c(NC(=O)NN=Cc2ccccc2OCC)sc(C(C)=O)c1C
InChIInChI=1S/C20H23N3O5S/c1-5-27-15-10-8-7-9-14(15)11-21-23-20(26)22-18-16(19(25)28-6-2)12(3)17(29-18)13(4)24/h7-11H,5-6H2,1-4H3,(H2,22,23,26)
InChIKeyVJOLUBNNOFXLMP-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)
5-acetyl-2-[[[2-[(2-ethoxyphenyl)methylidene]hydrazinyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester (CHEBI:111463) is a thiophenecarboxylic acid (CHEBI:48436)
Manual XrefsDatabases
LSM-22919LINCS