Vitas-M small molecule compound

(5Z)-1-(3-chloro-4-methoxyphenyl)-5-(3,4-dihydroxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK090448
SMILES COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2ccc(c(c2)O)O)/C1=O

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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 C18H13ClN2O6 MW 388.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN2O6/c1-27-15-5-3-10(8-12(15)19)21-17(25)11(16(24)20-18(21)26)6-9-2-4-13(22)14(23)7-9/h2-8,22-23H,1H3,(H,20,24,26)/b11-6-
InChIKey
KJPBKCFNMUBLNM-WDZFZDKYSA-N
Synonyms
736944-54-0
(5Z)1(3CHLORO4METHOXYPHENYL)5((34DIHYDROXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(3CHLORO4METHOXYPHENYL)5(34DIHYDROXYBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(Z)1(3chloro4methoxyphenyl)5(34dihydroxybenzylidene)pyrimidine246(1H3H5H)trione
736944540
COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)O)O)C(=O)NC2=O)Cl
COc1ccc(cc1Cl)N1C(=O)NC(=O)C(=Cc2ccc(c(c2)O)O)C1=O
InChI=1SC18H13ClN2O6c127155310(812(15)19)2117(25)11(16(24)2018(21)26)692413(22)14(23)79h282223H1H3(H202426)b116
MFCD03678949
STK090448
ZINC000008739934
ZINC08739934
ZINC18142248
ZINC8739934

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Available files

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