Vitas-M small molecule compound

(2E)-but-2-en-1-yl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK402412
SMILES C/C=C/COC(=O)C1=C(C)NC(=O)NC1c1cc(Br)c(c(c1)OC)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 C17H19BrN2O5 MW 411.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19BrN2O5/c1-4-5-6-25-16(22)13-9(2)19-17(23)20-14(13)10-7-11(18)15(21)12(8-10)24-3/h4-5,7-8,14,21H,6H2,1-3H3,(H2,19,20,23)/b5-4+
InChIKey
YLJVLDDAGCWCEB-SNAWJCMRSA-N
Synonyms

((E)BUT2ENYL)4(3BROMO4HYDROXY5METHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
(2E)but2en1yl4(3bromo4hydroxy5methoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
(2E)BUT2ENYL6(3BROMO4HYDROXY5METHOXYPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
CC=CCOC(=O)C1=C(C)NC(=O)NC1c1cc(Br)c(c(c1)OC)O
CC=CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C(=C2)Br)O)OC)C
InChI=1SC17H19BrN2O5c14562516(22)139(2)1917(23)2014(13)10711(18)15(21)12(810)243h45781421H6H213H3(H2192023)b54+
MFCD01193158
ZINC000002478412
ZINC000004189416

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Available files

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