Vitas-M small molecule compound
(5E)-1-(3-bromophenyl)-5-[3-fluoro-4-(pyrrolidin-1-yl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK172153
SMILES Brc1cccc(c1)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/c22-14-4-3-5-15(12-14)26-20(28)16(19(27)24-21(26)29)10-13-6-7-18(17(23)11-13)25-8-1-2-9-25/h3-7,10-12H,1-2,8-9H2,(H,24,27,29)/b16-10+InChIKey
UMENBRUNXFZFRX-MHWRWJLKSA-NSynonyms
(5E)1(3BROMOPHENYL)5((3FLUORO4PYRROLIDIN1YLPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(3BROMOPHENYL)5(3FLUORO4(PYRROLIDIN1YL)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
Brc1cccc(c1)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(=CC=C4)Br)F
InChI=1SC21H17BrFN3O3c221443515(1214)2620(28)16(19(27)2421(26)29)10136718(17(23)1113)25812925h371012H1289H2(H242729)b1610+
MFCD03993992
ZINC000001129423
ZINC01129423
ZINC1129423
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