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CHEBI:40305 - 2-methyl-2-(4-{[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}carbonyl)amino]methyl}phenoxy)propanoic acid

ChEBI IDCHEBI:40305
ChEBI Name2-methyl-2-(4-{[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}carbonyl)amino]methyl}phenoxy)propanoic acid
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC23H21F3N2O4S
Net Charge0
Average Mass478.492
Monoisotopic Mass478.11741
SMILES[H]OC(=O)C(Oc1c([H])c([H])c(C([H])([H])N([H])C(=O)c2sc(-c3c([H])c([H])c(C(F)(F)F)c([H])c3[H])nc2C([H])([H])[H])c([H])c1[H])(C([H])([H])[H])C([H])([H])[H]
InChIInChI=1S/C23H21F3N2O4S/c1-13-18(33-20(28-13)15-6-8-16(9-7-15)23(24,25)26)19(29)27-12-14-4-10-17(11-5-14)32-22(2,3)21(30)31/h4-11H,12H2,1-3H3,(H,27,29)(H,30,31)
InChIKeyILUPZUOBHCUBKB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-methyl-2-(4-{[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}carbonyl)amino]methyl}phenoxy)propanoic acid (CHEBI:40305) has functional parent propionic acid (CHEBI:30768)
2-methyl-2-(4-{[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}carbonyl)amino]methyl}phenoxy)propanoic acid (CHEBI:40305) is a 1,3-thiazolecarboxamide (CHEBI:48890)
2-methyl-2-(4-{[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}carbonyl)amino]methyl}phenoxy)propanoic acid (CHEBI:40305) is a organofluorine compound (CHEBI:37143)
Synonyms  Source
2-METHYL-2-(4-{[({4-METHYL-2-[4-(TRIFLUOROMETHYL)PHENYL]-1,3-THIAZOL-5-YL}CARBONYL)AMINO]METHYL}PHENOXY)PROPANOIC ACIDPDBeChem
2-methyl-2-(4-{[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}carbonyl)amino]methyl}phenoxy)propanoic acidPDBeChem
Manual XrefsDatabases
735PDBeChem