Vitas-M small molecule compound
ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate
Catalog ID
STL170886
SMILES CCOC(=O)C1=C(CC(=O)OCC)OC(=C(C1c1ccccc1C(F)(F)F)C#N)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 C20H19F3N2O5 MW 424.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N2O5/c1-3-28-15(26)9-14-17(19(27)29-4-2)16(12(10-24)18(25)30-14)11-7-5-6-8-13(11)20(21,22)23/h5-8,16H,3-4,9,25H2,1-2H3InChIKey
PQTCOSWZYAKYCI-UHFFFAOYSA-NSynonyms
340807-52-5340807525
CCOC(=O)CC1=C(C(C(=C(O1)N)C#N)C2=CC=CC=C2C(F)(F)F)C(=O)OCC
ethyl6amino5cyano2(2ethoxy2oxoethyl)4(2(trifluoromethyl)phenyl)4Hpyran3carboxylate
InChI=1SC20H19F3N2O5c132815(26)91417(19(27)2942)16(12(1024)18(25)3014)11756813(11)20(2122)23h5816H34925H212H3
MFCD01416783
ZINC000000989033
ZINC000000989034
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