Vitas-M small molecule compound
ethyl 6-amino-5-cyano-4-{5-[(2,6-dimethoxyphenoxy)methyl]-2,4-dimethylphenyl}-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STK956109
SMILES CCOC(=O)C1=C(C)OC(=C(C1c1cc(COc2c(OC)cccc2OC)c(cc1C)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 C27H30N2O6 MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O6/c1-7-33-27(30)23-17(4)35-26(29)20(13-28)24(23)19-12-18(15(2)11-16(19)3)14-34-25-21(31-5)9-8-10-22(25)32-6/h8-12,24H,7,14,29H2,1-6H3InChIKey
DJIQQCIFPNWXCO-UHFFFAOYSA-NSynonyms
438222-20-9438222209
CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2C)C)COC3=C(C=CC=C3OC)OC)C#N)N)C
ethyl6amino5cyano4(5((26dimethoxyphenoxy)methyl)24dimethylphenyl)2methyl4Hpyran3carboxylate
InChI=1SC27H30N2O6c173327(30)2317(4)3526(29)20(1328)24(23)191218(15(2)1116(19)3)14342521(315)981022(25)326h81224H71429H216H3
MFCD03074588
ZINC000000650868
ZINC000000650870
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.