Vitas-M small molecule compound
ethyl {4-bromo-2-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}acetate
Catalog ID
STL431692
SMILES CCOC(=O)COc1ccc(cc1C=C1C(=O)NC(=O)NC1=O)Br
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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 C15H13BrN2O6 MW 397.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13BrN2O6/c1-2-23-12(19)7-24-11-4-3-9(16)5-8(11)6-10-13(20)17-15(22)18-14(10)21/h3-6H,2,7H2,1H3,(H2,17,18,20,21,22)InChIKey
PSHGBBNQTSDPFY-UHFFFAOYSA-NSynonyms
CCOC(=O)COC1=C(C=C(C=C1)Br)C=C2C(=O)NC(=O)NC2=O
ethyl(4bromo2((246trioxotetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)acetate
ETHYL2(4BROMO2((246TRIOXO(13DIHYDROPYRIMIDIN5YLIDENE))METHYL)PHENOXY)ACETATE
ETHYL2(4BROMO2((246TRIOXO13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETATE
InChI=1SC15H13BrN2O6c122312(19)72411439(16)58(11)61013(20)1715(22)1814(10)21h36H27H21H3(H21718202122)
MFCD00850450
ZINC000005200421
ZINC05200421
ZINC5200421
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