Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-2-oxoethyl 4-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-4-oxobutanoate
Catalog ID
STK269633
SMILES O=C(OCC(=O)c1ccc(c(c1)C)C)CCC(=O)Nc1cc(ccc1Cl)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 C21H19ClF3NO4 MW 441.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClF3NO4/c1-12-3-4-14(9-13(12)2)18(27)11-30-20(29)8-7-19(28)26-17-10-15(21(23,24)25)5-6-16(17)22/h3-6,9-10H,7-8,11H2,1-2H3,(H,26,28)InChIKey
WNTLFIZZNWMMIZ-UHFFFAOYSA-NSynonyms
(2(34DIMETHYLPHENYL)2OXOETHYL)4(2CHLORO5(TRIFLUOROMETHYL)ANILINO)4OXOBUTANOATE
2(34dimethylphenyl)2oxoethyl4((2chloro5(trifluoromethyl)phenyl)amino)4oxobutanoate
CC1=C(C=C(C=C1)C(=O)COC(=O)CCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)C
InChI=1SC21H19ClF3NO4c1123414(913(12)2)18(27)113020(29)8719(28)26171015(21(2324)25)5616(17)22h36910H7811H212H3(H2628)
MFCD02763306
ZINC000009203208
ZINC09203208
ZINC9203208
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