Vitas-M small molecule compound
3-(3-methylbenzyl)-4-oxo-4-{[4-(trifluoromethoxy)phenyl]amino}butanoic acid
Catalog ID
STK680935
SMILES OC(=O)CC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Cc1cccc(c1)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/c1-12-3-2-4-13(9-12)10-14(11-17(24)25)18(26)23-15-5-7-16(8-6-15)27-19(20,21)22/h2-9,14H,10-11H2,1H3,(H,23,26)(H,24,25)InChIKey
SAJAGBCAFKVXTR-UHFFFAOYSA-NSynonyms
(3S)3(3METHYLBENZYL)4OXO4((4(TRIFLUOROMETHOXY)PHENYL)AMINO)BUTANOICACID
3((3METHYLPHENYL)METHYL)4OXO4(4(TRIFLUOROMETHOXY)ANILINO)BUTANOICACID
3(3methylbenzyl)4oxo4((4(trifluoromethoxy)phenyl)amino)butanoicacid
CC1=CC(=CC=C1)CC(CC(=O)O)C(=O)NC2=CC=C(C=C2)OC(F)(F)F
InChI=1SC19H18F3NO4c11232413(912)1014(1117(24)25)18(26)23155716(8615)2719(2021)22h2914H1011H21H3(H2326)(H2425)
MFCD03767758
ZINC000004581067
ZINC000004581069
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