Vitas-M small molecule compound
(5Z)-1-[4-(benzyloxy)phenyl]-5-(3-chloro-5-ethoxy-4-hydroxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484544
SMILES CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)OCc2ccccc2)cc(c1O)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/c1-2-34-22-14-17(13-21(27)23(22)30)12-20-24(31)28-26(33)29(25(20)32)18-8-10-19(11-9-18)35-15-16-6-4-3-5-7-16/h3-14,30H,2,15H2,1H3,(H,28,31,33)/b20-12-InChIKey
YWRRKPARIFOTMB-NDENLUEZSA-NSynonyms
(5Z)1(4(benzyloxy)phenyl)5(3chloro5ethoxy4hydroxybenzylidene)pyrimidine246(1H3H5H)trione
(5Z)5((3chloro5ethoxy4hydroxyphenyl)methylidene)1(4phenylmethoxyphenyl)13diazinane246trione
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)Cl)O
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)OCc2ccccc2)cc(c1O)Cl
InChI=1SC26H21ClN2O6c1234221417(1321(27)23(22)30)122024(31)2826(33)29(25(20)32)1881019(11918)3515166435716h31430H215H21H3(H283133)b2012
MFCD30713608
ZINC000038166894
ZINC38166894
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