Vitas-M small molecule compound

(5Z)-5-[4-(2-bromoethoxy)-3-ethoxybenzylidene]-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK083770
SMILES BrCCOc1ccc(cc1OCC)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)OC

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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 C22H21BrN2O6 MW 489.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrN2O6/c1-3-30-19-13-14(4-9-18(19)31-11-10-23)12-17-20(26)24-22(28)25(21(17)27)15-5-7-16(29-2)8-6-15/h4-9,12-13H,3,10-11H2,1-2H3,(H,24,26,28)/b17-12-
InChIKey
AVUBVWISVADZKM-ATVHPVEESA-N
Synonyms

(5Z)5((4(2bromoethoxy)3ethoxyphenyl)methylidene)1(4methoxyphenyl)13diazinane246trione
(5Z)5(4(2BROMOETHOXY)3ETHOXYBENZYLIDENE)1(4METHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
BrCCOc1ccc(cc1OCC)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)OC
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OC)OCCBr
InChI=1SC22H21BrN2O6c1330191314(4918(19)31111023)121720(26)2422(28)25(21(17)27)155716(292)8615h491213H31011H212H3(H242628)b1712
MFCD02017810
STK083770
ZINC000009678952
ZINC09678952
ZINC9678952

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Available files

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