Vitas-M small molecule compound
ethyl {5-bromo-4-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2-methoxyphenoxy}acetate
Catalog ID
STL419357
SMILES CCOC(=O)COc1cc(Br)c(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 C18H19BrN2O7 MW 455.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19BrN2O7/c1-5-27-15(22)9-28-14-8-12(19)10(7-13(14)26-4)6-11-16(23)20(2)18(25)21(3)17(11)24/h6-8H,5,9H2,1-4H3InChIKey
OPGLTVUSXFIAMF-UHFFFAOYSA-NSynonyms
CCOC(=O)COC1=C(C=C(C(=C1)Br)C=C2C(=O)N(C(=O)N(C2=O)C)C)OC
ethyl(5bromo4((13dimethyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)2methoxyphenoxy)acetate
ETHYL2(5BROMO4((13DIMETHYL246TRIOXO13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)ACETATE
InChI=1SC18H19BrN2O7c152715(22)92814812(19)10(713(14)264)61116(23)20(2)18(25)21(3)17(11)24h68H59H214H3
MFCD01036125
ZINC000001100186
ZINC01100186
ZINC1100186
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