Vitas-M small molecule compound
2-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-oxoethyl (2E)-3-(3,4-dimethoxyphenyl)prop-2-enoate
Catalog ID
STL187371
SMILES COc1cc(/C=C/C(=O)OCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)ccc1OC
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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 C20H17ClF3NO5 MW 443.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClF3NO5/c1-28-16-7-3-12(9-17(16)29-2)4-8-19(27)30-11-18(26)25-15-10-13(20(22,23)24)5-6-14(15)21/h3-10H,11H2,1-2H3,(H,25,26)/b8-4+InChIKey
RGEAOFSPCFTSSS-XBXARRHUSA-NSynonyms
(2(2CHLORO5(TRIFLUOROMETHYL)ANILINO)2OXOETHYL)(E)3(34DIMETHOXYPHENYL)PROP2ENOATE
2((2chloro5(trifluoromethyl)phenyl)amino)2oxoethyl(2E)3(34dimethoxyphenyl)prop2enoate
COC1=C(C=C(C=C1)C=CC(=O)OCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)OC
COc1cc(C=CC(=O)OCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)ccc1OC
InChI=1SC20H17ClF3NO5c128167312(917(16)292)4819(27)301118(26)25151013(20(2223)24)5614(15)21h310H11H212H3(H2526)b84+
MFCD04597361
ZINC000001962756
ZINC1962756
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