Vitas-M small molecule compound
(5Z)-5-(3-chloro-4-hydroxy-5-methoxybenzylidene)-1-(2,5-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484446
SMILES COc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2cc(C)ccc2C)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 C20H17ClN2O5 MW 400.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O5/c1-10-4-5-11(2)15(6-10)23-19(26)13(18(25)22-20(23)27)7-12-8-14(21)17(24)16(9-12)28-3/h4-9,24H,1-3H3,(H,22,25,27)/b13-7-InChIKey
XXCIIABNRRBIQK-QPEQYQDCSA-NSynonyms
(5Z)5((3chloro4hydroxy5methoxyphenyl)methylidene)1(25dimethylphenyl)13diazinane246trione
(5Z)5(3chloro4hydroxy5methoxybenzylidene)1(25dimethylphenyl)pyrimidine246(1H3H5H)trione
CC1=CC(=C(C=C1)C)N2C(=O)C(=CC3=CC(=C(C(=C3)Cl)O)OC)C(=O)NC2=O
COc1cc(C=C2C(=O)NC(=O)N(C2=O)c2cc(C)ccc2C)cc(c1O)Cl
InChI=1SC20H17ClN2O5c1104511(2)15(610)2319(26)13(18(25)2220(23)27)712814(21)17(24)16(912)283h4924H13H3(H222527)b137
MFCD30713526
ZINC000034234818
ZINC34234818
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