Vitas-M small molecule compound
(5E)-5-{3-bromo-5-ethoxy-4-[2-(4-methoxyphenoxy)ethoxy]benzylidene}-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK092043
SMILES CCOc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCCOc1ccc(cc1)OC)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 C28H24BrClN2O7 MW 615.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24BrClN2O7/c1-3-37-24-16-17(15-23(29)25(24)39-13-12-38-21-10-8-20(36-2)9-11-21)14-22-26(33)31-28(35)32(27(22)34)19-6-4-18(30)5-7-19/h4-11,14-16H,3,12-13H2,1-2H3,(H,31,33,35)/b22-14+InChIKey
MUNSGIDWTYGYEY-HYARGMPZSA-NSynonyms
(5E)5((3BROMO5ETHOXY4(2(4METHOXYPHENOXY)ETHOXY)PHENYL)METHYLIDENE)1(4CHLOROPHENYL)13DIAZINANE246TRIONE
(5E)5(3BROMO5ETHOXY4(2(4METHOXYPHENOXY)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=C(C=C4)OC
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCCOc1ccc(cc1)OC)Br
InChI=1SC28H24BrClN2O7c1337241617(1523(29)25(24)391312382110820(362)91121)142226(33)3128(35)32(27(22)34)196418(30)5719h4111416H31213H212H3(H313335)b2214+
MFCD08672752
STK092043
ZINC000097959217
ZINC97959217
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