Vitas-M small molecule compound
2-(4-methoxybenzyl)-4-oxo-4-{[3-(trifluoromethyl)phenyl]amino}butanoic acid
Catalog ID
STL442347
SMILES COc1ccc(cc1)CC(C(=O)O)CC(=O)Nc1cccc(c1)C(F)(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H18F3NO4 MW 381.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F3NO4/c1-27-16-7-5-12(6-8-16)9-13(18(25)26)10-17(24)23-15-4-2-3-14(11-15)19(20,21)22/h2-8,11,13H,9-10H2,1H3,(H,23,24)(H,25,26)InChIKey
HUIITDHBGGLFIT-UHFFFAOYSA-NSynonyms
2((4methoxyphenyl)methyl)4oxo4(3(trifluoromethyl)anilino)butanoicacid
2(4methoxybenzyl)4oxo4((3(trifluoromethyl)phenyl)amino)butanoicacid
COC1=CC=C(C=C1)CC(CC(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)O
InChI=1SC19H18F3NO4c127167512(6816)913(18(25)26)1017(24)231542314(1115)19(2021)22h281113H910H21H3(H2324)(H2526)
MFCD19442623
ZINC000071405955
ZINC000071405956
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