Vitas-M small molecule compound
(5Z)-1-{4-[(4-chlorobenzyl)oxy]phenyl}-5-(3,4-dimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484552
SMILES COc1ccc(cc1OC)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)OCc1ccc(cc1)Cl
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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 C26H21ClN2O6 MW 492.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN2O6/c1-33-22-12-5-17(14-23(22)34-2)13-21-24(30)28-26(32)29(25(21)31)19-8-10-20(11-9-19)35-15-16-3-6-18(27)7-4-16/h3-14H,15H2,1-2H3,(H,28,30,32)/b21-13-InChIKey
GXBRLISUVPZOIY-BKUYFWCQSA-NSynonyms
(5Z)1(4((4chlorobenzyl)oxy)phenyl)5(34dimethoxybenzylidene)pyrimidine246(1H3H5H)trione
(5Z)1(4((4chlorophenyl)methoxy)phenyl)5((34dimethoxyphenyl)methylidene)13diazinane246trione
COC1=C(C=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OCC4=CC=C(C=C4)Cl)OC
COc1ccc(cc1OC)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)OCc1ccc(cc1)Cl
InChI=1SC26H21ClN2O6c1332212517(1423(22)342)132124(30)2826(32)29(25(21)31)1981020(11919)3515163618(27)7416h314H15H212H3(H283032)b2113
MFCD30713616
ZINC000033417609
ZINC33417609
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