Vitas-M small molecule compound
methyl 6-amino-5-cyano-4-{4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STL171253
SMILES COC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1)COCC(F)(F)F)OC)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 C19H19F3N2O5 MW 412.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19F3N2O5/c1-10-15(18(25)27-3)16(13(7-23)17(24)29-10)11-4-5-14(26-2)12(6-11)8-28-9-19(20,21)22/h4-6,16H,8-9,24H2,1-3H3InChIKey
CAKRTJAZNYAGLH-UHFFFAOYSA-NSynonyms
352682-62-3352682623
CC1=C(C(C(=C(O1)N)C#N)C2=CC(=C(C=C2)OC)COCC(F)(F)F)C(=O)OC
InChI=1SC19H19F3N2O5c11015(18(25)273)16(13(723)17(24)2910)114514(262)12(611)828919(2021)22h4616H8924H213H3
METHYL(4S)6AMINO5CYANO4(4METHOXY3((222TRIFLUOROETHOXY)METHYL)PHENYL)2METHYL4HPYRAN3CARBOXYLATE
methyl6amino5cyano4(4methoxy3((222trifluoroethoxy)methyl)phenyl)2methyl4Hpyran3carboxylate
METHYL6AMINO5CYANO4(4METHOXY3(222TRIFLUOROETHOXYMETHYL)PHENYL)2METHYL4HPYRAN3CARBOXYLATE
MFCD01919096
ZINC000000996320
ZINC000000996321
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