Vitas-M small molecule compound
(5Z)-1-(4-chloro-2,5-dimethoxyphenyl)-5-(2,4-dimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484417
SMILES COc1ccc(c(c1)OC)/C=C\1/C(=O)NC(=O)N(C1=O)c1cc(OC)c(cc1OC)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 C21H19ClN2O7 MW 446.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O7/c1-28-12-6-5-11(16(8-12)29-2)7-13-19(25)23-21(27)24(20(13)26)15-10-17(30-3)14(22)9-18(15)31-4/h5-10H,1-4H3,(H,23,25,27)/b13-7-InChIKey
NEJMICROVHGTNU-QPEQYQDCSA-NSynonyms
(5Z)1(4chloro25dimethoxyphenyl)5((24dimethoxyphenyl)methylidene)13diazinane246trione
(5Z)1(4chloro25dimethoxyphenyl)5(24dimethoxybenzylidene)pyrimidine246(1H3H5H)trione
COC1=CC(=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=C(C=C3OC)Cl)OC)OC
COc1ccc(c(c1)OC)C=C1C(=O)NC(=O)N(C1=O)c1cc(OC)c(cc1OC)Cl
InChI=1SC21H19ClN2O7c128126511(16(812)292)71319(25)2321(27)24(20(13)26)151017(303)14(22)918(15)314h510H14H3(H232527)b137
MFCD30713505
ZINC000033417653
ZINC33417653
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