Vitas-M small molecule compound

(5E)-5-(3-bromo-4-hydroxy-5-methoxybenzylidene)-1-[4-(propan-2-yl)phenyl]pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK170889
SMILES COc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)C(C)C)cc(c1O)Br

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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 C21H19BrN2O5 MW 459.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O5/c1-11(2)13-4-6-14(7-5-13)24-20(27)15(19(26)23-21(24)28)8-12-9-16(22)18(25)17(10-12)29-3/h4-11,25H,1-3H3,(H,23,26,28)/b15-8+
InChIKey
FSYYVOVPXPQWEL-OVCLIPMQSA-N
Synonyms

(5E)5((3BROMO4HYDROXY5METHOXYPHENYL)METHYLIDENE)1(4PROPAN2YLPHENYL)13DIAZINANE246TRIONE
(5E)5(3BROMO4HYDROXY5METHOXYBENZYLIDENE)1(4(PROPAN2YL)PHENYL)PYRIMIDINE246(1H3H5H)TRIONE
(5E)5(3BROMO4HYDROXY5METHOXYBENZYLIDENE)6HYDROXY3(4(PROPAN2YL)PHENYL)PYRIMIDINE24(3H5H)DIONE
(E)5(3bromo4hydroxy5methoxybenzylidene)1(4isopropylphenyl)pyrimidine246(1H3H5H)trione
CC(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)C(=O)NC2=O
COc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)C(C)C)cc(c1O)Br
InChI=1SC21H19BrN2O5c111(2)134614(7513)2420(27)15(19(26)2321(24)28)812916(22)18(25)17(1012)293h41125H13H3(H232628)b158+
MFCD02379412
ZINC8771019

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Available files

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