Vitas-M small molecule compound
ethyl 6-amino-5-cyano-4-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STL381275
SMILES CCOC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1)OC)OCC#C)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 C20H20N2O5 MW 368.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O5/c1-5-9-26-15-8-7-13(10-16(15)24-4)18-14(11-21)19(22)27-12(3)17(18)20(23)25-6-2/h1,7-8,10,18H,6,9,22H2,2-4H3InChIKey
HDJSOLYJNPWJEJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2)OCC#C)OC)C#N)N)C
ethyl6amino5cyano4(3methoxy4(prop2yn1yloxy)phenyl)2methyl4Hpyran3carboxylate
ETHYL6AMINO5CYANO4(3METHOXY4PROP2YNOXYPHENYL)2METHYL4HPYRAN3CARBOXYLATE
ETHYL6AMINO5CYANO4(3METHOXY4PROP2YNYLOXYPHENYL)2METHYL4HPYRAN3CARBOXYLATE
InChI=1SC20H20N2O5c15926158713(1016(15)244)1814(1121)19(22)2712(3)17(18)20(23)2562h1781018H6922H224H3
MFCD05134075
ZINC000004501849
ZINC000004501850
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