CHEBI:107924 - 2-thiophenecarboxylic acid [2-ethoxy-4-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]phenyl] ester

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ChEBI Name 2-thiophenecarboxylic acid [2-ethoxy-4-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]phenyl] ester
ChEBI ID CHEBI:107924
Stars This entity has been manually annotated by a third party.
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Formula C24H20N2O4S
Net Charge 0
Average Mass 432.494
Monoisotopic Mass 432.11438
InChI InChI=1S/C24H20N2O4S/c1-3-29-21-15-17(11-12-20(21)30-24(28)22-10-7-13-31-22)14-19-16(2)25-26(23(19)27)18-8-5-4-6-9-18/h4-15H,3H2,1-2H3
InChIKey OTGWKWLVMHNKNV-UHFFFAOYSA-N
SMILES CCOC1=C(C=CC(=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)OC(=O)C4=CC=CS4
ChEBI Ontology
Outgoing 2-thiophenecarboxylic acid [2-ethoxy-4-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]phenyl] ester (CHEBI:107924) is a benzoate ester (CHEBI:36054)
2-thiophenecarboxylic acid [2-ethoxy-4-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]phenyl] ester (CHEBI:107924) is a phenols (CHEBI:33853)
Manual Xref Database
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