Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-[3-fluoro-4-(pyrrolidin-1-yl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK172161
SMILES Brc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(c(c2)F)N2CCCC2)/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 C21H17BrFN3O3 MW 458.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrFN3O3/c22-14-4-6-15(7-5-14)26-20(28)16(19(27)24-21(26)29)11-13-3-8-18(17(23)12-13)25-9-1-2-10-25/h3-8,11-12H,1-2,9-10H2,(H,24,27,29)/b16-11+InChIKey
VUGDGYOGRWXFKJ-LFIBNONCSA-NSynonyms
(5E)1(4BROMOPHENYL)5((3FLUORO4PYRROLIDIN1YLPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4BROMOPHENYL)5(3FLUORO4(PYRROLIDIN1YL)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
Brc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(c(c2)F)N2CCCC2)C1=O
C1CCN(C1)C2=C(C=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Br)F
InChI=1SC21H17BrFN3O3c22144615(7514)2620(28)16(19(27)2421(26)29)11133818(17(23)1213)259121025h381112H12910H2(H242729)b1611+
MFCD03923162
ZINC000001128817
ZINC01128817
ZINC1128817
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