Vitas-M small molecule compound
ethyl (2E)-3-{3-chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}-2-cyanoprop-2-enoate
Catalog ID
STK006095
SMILES CCOC(=O)/C(=C/c1cc(Cl)c(c(c1)OC)OCc1ccc(cc1)F)/C#N
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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 C20H17ClFNO4 MW 389.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClFNO4/c1-3-26-20(24)15(11-23)8-14-9-17(21)19(18(10-14)25-2)27-12-13-4-6-16(22)7-5-13/h4-10H,3,12H2,1-2H3/b15-8+InChIKey
XCLKRXBKFCIQBH-OVCLIPMQSA-NSynonyms
CCOC(=O)C(=CC1=CC(=C(C(=C1)Cl)OCC2=CC=C(C=C2)F)OC)C#N
CCOC(=O)C(=Cc1cc(Cl)c(c(c1)OC)OCc1ccc(cc1)F)C#N
ETHYL(2E)3(3CHLORO4((4FLUOROBENZYL)OXY)5METHOXYPHENYL)2CYANOPROP2ENOATE
ETHYL(E)3(3CHLORO4((4FLUOROPHENYL)METHOXY)5METHOXYPHENYL)2CYANOPROP2ENOATE
InChI=1SC20H17ClFNO4c132620(24)15(1123)814917(21)19(18(1014)252)2712134616(22)7513h410H312H212H3b158+
MFCD02125627
STK006095
ZINC000004550410
ZINC04550410
ZINC4550410
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