Vitas-M small molecule compound
(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-1-(2,5-dimethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK828512
SMILES COc1ccc(c(c1)N1C(=O)NC(=O)/C(=C/c2ccc3c(c2)OCO3)/C1=O)OC
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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 C20H16N2O7 MW 396.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O7/c1-26-12-4-6-15(27-2)14(9-12)22-19(24)13(18(23)21-20(22)25)7-11-3-5-16-17(8-11)29-10-28-16/h3-9H,10H2,1-2H3,(H,21,23,25)/b13-7-InChIKey
YKKGJGVYVHILBJ-QPEQYQDCSA-NSynonyms
(5Z)5(13BENZODIOXOL5YLMETHYLIDENE)1(25DIMETHOXYPHENYL)13DIAZINANE246TRIONE
(5Z)5(13benzodioxol5ylmethylidene)1(25dimethoxyphenyl)pyrimidine246(1H3H5H)trione
(E)5(benzo(d)(13)dioxol5ylmethylene)1(25dimethoxyphenyl)pyrimidine246(1H3H5H)trione
COC1=CC(=C(C=C1)OC)N2C(=O)C(=CC3=CC4=C(C=C3)OCO4)C(=O)NC2=O
COc1ccc(c(c1)N1C(=O)NC(=O)C(=Cc2ccc3c(c2)OCO3)C1=O)OC
InChI=1SC20H16N2O7c126124615(272)14(912)2219(24)13(18(23)2120(22)25)711351617(811)29102816h39H10H212H3(H212325)b137
MFCD02924335
ZINC000004755049
ZINC04755049
ZINC4755049
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