Vitas-M small molecule compound
methyl {4-[(E)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]-2-methoxyphenoxy}acetate
Catalog ID
STK618840
SMILES COC(=O)COc1ccc(cc1OC)/C=C/1\C(=NC(=NC1=O)S)O
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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 C15H14N2O6S MW 350.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O6S/c1-21-11-6-8(3-4-10(11)23-7-12(18)22-2)5-9-13(19)16-15(24)17-14(9)20/h3-6H,7H2,1-2H3,(H2,16,17,19,20,24)InChIKey
ZWGAJSMBPUDORL-UHFFFAOYSA-NSynonyms
COC(=O)COc1ccc(cc1OC)C=C1C(=NC(=NC1=O)S)O
COC1=C(C=CC(=C1)C=C2C(=O)NC(=S)NC2=O)OCC(=O)OC
InChI=1SC15H14N2O6Sc1211168(3410(11)23712(18)222)5913(19)1615(24)1714(9)20h36H7H212H3(H21617192024)
METHYL(4((46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2METHOXYPHENOXY)ACETATE
methyl(4((E)(6hydroxy4oxo2sulfanylpyrimidin5(4H)ylidene)methyl)2methoxyphenoxy)acetate
METHYL2(4((46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)ACETATE
MFCD09794909
ZINC000001200822
ZINC1200822
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