Vitas-M small molecule compound
ethyl (2-{(E)-2-[3-(2-fluorobenzyl)-2-oxo-6-(trifluoromethyl)-2,3-dihydropyrimidin-4-yl]ethenyl}-6-methoxyphenoxy)acetate
Catalog ID
STK743941
SMILES CCOC(=O)COc1c(cccc1OC)/C=C/c1cc(nc(=O)n1Cc1ccccc1F)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 C25H22F4N2O5 MW 506.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22F4N2O5/c1-3-35-22(32)15-36-23-16(8-6-10-20(23)34-2)11-12-18-13-21(25(27,28)29)30-24(33)31(18)14-17-7-4-5-9-19(17)26/h4-13H,3,14-15H2,1-2H3/b12-11+InChIKey
DRMNJTWMKCDLMX-VAWYXSNFSA-NSynonyms
CCOC(=O)COC1=C(C=CC=C1OC)C=CC2=CC(=NC(=O)N2CC3=CC=CC=C3F)C(F)(F)F
CCOC(=O)COc1c(cccc1OC)C=Cc1cc(nc(=O)n1Cc1ccccc1F)C(F)(F)F
ethyl(2((E)2(3(2fluorobenzyl)2oxo6(trifluoromethyl)23dihydropyrimidin4yl)ethenyl)6methoxyphenoxy)acetate
ETHYL2(2((E)2(3((2FLUOROPHENYL)METHYL)2OXO6(TRIFLUOROMETHYL)PYRIMIDIN4YL)ETHENYL)6METHOXYPHENOXY)ACETATE
InChI=1SC25H22F4N2O5c133522(32)15362316(861020(23)342)1112181321(25(2728)29)3024(33)31(18)1417745919(17)26h413H31415H212H3b1211+
MFCD06017546
ZINC000012413383
ZINC12413383
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