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CHEBI:107791 - 2-[5-[[3-[4-(2-methylpropoxy)phenyl]-1-phenyl-4-pyrazolyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid

ChEBI IDCHEBI:107791
ChEBI Name2-[5-[[3-[4-(2-methylpropoxy)phenyl]-1-phenyl-4-pyrazolyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid
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DownloadsMolfile
FormulaC25H23N3O4S2
Net Charge0
Average Mass493.610
Monoisotopic Mass493.11300
SMILESCC(C)COc1ccc(-c2nn(-c3ccccc3)cc2C=C2SC(=S)N(CC(=O)O)C2=O)cc1
InChIInChI=1S/C25H23N3O4S2/c1-16(2)15-32-20-10-8-17(9-11-20)23-18(13-28(26-23)19-6-4-3-5-7-19)12-21-24(31)27(14-22(29)30)25(33)34-21/h3-13,16H,14-15H2,1-2H3,(H,29,30)
InChIKeySALDPLRWBABLIU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[5-[[3-[4-(2-methylpropoxy)phenyl]-1-phenyl-4-pyrazolyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid (CHEBI:107791) is a pyrazoles (CHEBI:26410)
2-[5-[[3-[4-(2-methylpropoxy)phenyl]-1-phenyl-4-pyrazolyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid (CHEBI:107791) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-19168LINCS