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CHEBI:120483 - 3-[[[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]benzoic acid

ChEBI IDCHEBI:120483
ChEBI Name3-[[[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]benzoic acid
Stars
DownloadsMolfile
FormulaC20H15F3N2O3S
Net Charge0
Average Mass420.412
Monoisotopic Mass420.07555
SMILESCOc1ccc(-c2cc(C(F)(F)F)nc(SCc3cccc(C(=O)O)c3)n2)cc1
InChIInChI=1S/C20H15F3N2O3S/c1-28-15-7-5-13(6-8-15)16-10-17(20(21,22)23)25-19(24-16)29-11-12-3-2-4-14(9-12)18(26)27/h2-10H,11H2,1H3,(H,26,27)
InChIKeyBYHGFIYOZJWIDJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[[[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]benzoic acid (CHEBI:120483) is a pyrimidines (CHEBI:39447)
Manual XrefsDatabases
LSM-31926LINCS