Vitas-M small molecule compound
(5Z)-5-{3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]benzylidene}-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK065797
SMILES CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCCOc1ccccc1C)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 C28H24BrClN2O6 MW 599.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24BrClN2O6/c1-3-36-24-16-18(15-22(29)25(24)38-13-12-37-23-7-5-4-6-17(23)2)14-21-26(33)31-28(35)32(27(21)34)20-10-8-19(30)9-11-20/h4-11,14-16H,3,12-13H2,1-2H3,(H,31,33,35)/b21-14-InChIKey
UZKRCCNYWRSIEE-STZFKDTASA-NSynonyms
(5Z)5((3bromo5ethoxy4(2(2methylphenoxy)ethoxy)phenyl)methylidene)1(4chlorophenyl)13diazinane246trione
(5Z)5(3BROMO5ETHOXY4(2(2METHYLPHENOXY)ETHOXY)BENZYLIDENE)1(4CHLOROPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)Br)OCCOC4=CC=CC=C4C
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCCOc1ccccc1C)Br
InChI=1SC28H24BrClN2O6c1336241618(1522(29)25(24)3813123723754617(23)2)142126(33)3128(35)32(27(21)34)2010819(30)91120h4111416H31213H212H3(H313335)b2114
MFCD05976015
STK065797
ZINC000097958861
ZINC97958861
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