Vitas-M small molecule compound

methyl 4-[2-amino-3-cyano-5-(diethoxyphosphoryl)-6-phenyl-4H-pyran-4-yl]benzoate

Catalog ID
STK691981
SMILES CCOP(=O)(C1=C(OC(=C(C1c1ccc(cc1)C(=O)OC)C#N)N)c1ccccc1)OCC

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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 C24H25N2O6P MW 468.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N2O6P/c1-4-30-33(28,31-5-2)22-20(16-11-13-18(14-12-16)24(27)29-3)19(15-25)23(26)32-21(22)17-9-7-6-8-10-17/h6-14,20H,4-5,26H2,1-3H3
InChIKey
MSMMNYASRJRXHP-UHFFFAOYSA-N
Synonyms

CCOP(=O)(C1=C(OC(=C(C1C2=CC=C(C=C2)C(=O)OC)C#N)N)C3=CC=CC=C3)OCC
InChI=1SC24H25N2O6Pc143033(283152)2220(16111318(141216)24(27)293)19(1525)23(26)3221(22)1797681017h61420H4526H213H3
methyl4(2amino3cyano5(diethoxyphosphoryl)6phenyl4Hpyran4yl)benzoate
methyl4(2amino3cyano5diethoxyphosphoryl6phenyl4Hpyran4yl)benzoate
MFCD10037965
ZINC000015081959
ZINC000015081961

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.