Vitas-M small molecule compound

ethyl {4-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2-methoxyphenoxy}acetate

Catalog ID
STK698495
SMILES CCOC(=O)COc1ccc(cc1OC)C=C1C(=O)N(C)C(=O)N(C1=O)C

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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 C18H20N2O7 MW 376.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O7/c1-5-26-15(21)10-27-13-7-6-11(9-14(13)25-4)8-12-16(22)19(2)18(24)20(3)17(12)23/h6-9H,5,10H2,1-4H3
InChIKey
ZGQCVWNLOCIYQF-UHFFFAOYSA-N
Synonyms

CCOC(=O)COC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)N(C2=O)C)C)OC
ethyl(4((13dimethyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)2methoxyphenoxy)acetate
ETHYL2(4((13DIMETHYL246TRIOXO13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)ACETATE
InChI=1SC18H20N2O7c152615(21)1027137611(914(13)254)81216(22)19(2)18(24)20(3)17(12)23h69H510H214H3
MFCD00809192
ZINC000002898153
ZINC02898153
ZINC2898153

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Available files

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