Vitas-M small molecule compound
2-(4-methylbenzyl)-4-oxo-4-{[4-(trifluoromethoxy)phenyl]amino}butanoic acid
Catalog ID
STK682829
SMILES O=C(Nc1ccc(cc1)OC(F)(F)F)CC(C(=O)O)Cc1ccc(cc1)C
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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/c1-12-2-4-13(5-3-12)10-14(18(25)26)11-17(24)23-15-6-8-16(9-7-15)27-19(20,21)22/h2-9,14H,10-11H2,1H3,(H,23,24)(H,25,26)InChIKey
VTUAHHLUVVNVDO-UHFFFAOYSA-NSynonyms
(2S)2(4METHYLBENZYL)4OXO4((4(TRIFLUOROMETHOXY)PHENYL)AMINO)BUTANOICACID
2((4METHYLPHENYL)METHYL)4OXO4(4(TRIFLUOROMETHOXY)ANILINO)BUTANOICACID
2(4methylbenzyl)4oxo4((4(trifluoromethoxy)phenyl)amino)butanoicacid
CC1=CC=C(C=C1)CC(CC(=O)NC2=CC=C(C=C2)OC(F)(F)F)C(=O)O
InChI=1SC19H18F3NO4c1122413(5312)1014(18(25)26)1117(24)23156816(9715)2719(2021)22h2914H1011H21H3(H2324)(H2526)
MFCD04060929
ZINC000001445891
ZINC000001445892
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