Vitas-M small molecule compound
(5E)-5-{3-[2-(3-ethyl-5-methylphenoxy)ethoxy]benzylidene}-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK044077
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2cccc(c2)OCCOc2cc(C)cc(c2)CC)/C1=O
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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 C29H28N2O6 MW 500.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O6/c1-4-20-14-19(2)15-25(16-20)37-13-12-36-24-7-5-6-21(17-24)18-26-27(32)30-29(34)31(28(26)33)22-8-10-23(35-3)11-9-22/h5-11,14-18H,4,12-13H2,1-3H3,(H,30,32,34)/b26-18+InChIKey
HSHMDDSZJNHTPB-NLRVBDNBSA-NSynonyms
(5E)5((3(2(3ETHYL5METHYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
(5E)5(3(2(3ETHYL5METHYLPHENOXY)ETHOXY)BENZYLIDENE)1(4METHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCC1=CC(=CC(=C1)C)OCCOC2=CC=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cccc(c2)OCCOc2cc(C)cc(c2)CC)C1=O
InChI=1SC29H28N2O6c14201419(2)1525(1620)371312362475621(1724)182627(32)3029(34)31(28(26)33)2281023(353)11922h5111418H41213H213H3(H303234)b2618+
MFCD01873557
STK044077
ZINC000013942766
ZINC13942766
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