Vitas-M small molecule compound
(2-bromo-4-{(Z)-[1-(4-chlorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-6-methoxyphenoxy)acetic acid
Catalog ID
STK602084
SMILES COc1cc(/C=C\2/C(=NC(=O)N(C2=O)c2ccc(cc2)Cl)O)cc(c1OCC(=O)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 C20H14BrClN2O7 MW 509.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrClN2O7/c1-30-15-8-10(7-14(21)17(15)31-9-16(25)26)6-13-18(27)23-20(29)24(19(13)28)12-4-2-11(22)3-5-12/h2-8H,9H2,1H3,(H,25,26)(H,23,27,29)/b13-6-InChIKey
MKVHJGIMXNFEEY-MLPAPPSSSA-NSynonyms
(2bromo4((Z)(1(4chlorophenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)6methoxyphenoxy)aceticacid
2(2BROMO4((Z)(1(4CHLOROPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)6METHOXYPHENOXY)ACETICACID
COc1cc(C=C2C(=NC(=O)N(C2=O)c2ccc(cc2)Cl)O)cc(c1OCC(=O)O)Br
InChI=1SC20H14BrClN2O7c13015810(714(21)17(15)31916(25)26)61318(27)2320(29)24(19(13)28)124211(22)3512h28H9H21H3(H2526)(H232729)b136
MFCD08729872
ZINC000013801613
ZINC13801613
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