Vitas-M small molecule compound
6-[(E)-2-{5-bromo-2-[(4-fluorobenzyl)oxy]phenyl}ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Catalog ID
STK287063
SMILES Brc1ccc(c(c1)/C=C/c1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-])OCc1ccc(cc1)F
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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 C19H13BrFN3O5 MW 462.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13BrFN3O5/c20-13-4-8-16(29-10-11-1-5-14(21)6-2-11)12(9-13)3-7-15-17(24(27)28)18(25)23-19(26)22-15/h1-9H,10H2,(H2,22,23,25,26)/b7-3+InChIKey
HFTBXAGPZPKYLL-XVNBXDOJSA-NSynonyms
6((E)2(5BROMO2((4FLUOROBENZYL)OXY)PHENYL)ETHENYL)5NITROPYRIMIDINE24(1H3H)DIONE
6((E)2(5BROMO2((4FLUOROBENZYL)OXY)PHENYL)ETHENYL)5NITROPYRIMIDINE24DIOL
6((E)2(5BROMO2((4FLUOROPHENYL)METHOXY)PHENYL)ETHENYL)5NITRO1HPYRIMIDINE24DIONE
Brc1ccc(c(c1)C=Cc1(nH)c(=O)(nH)c(=O)c1(N+)(=O)(O))OCc1ccc(cc1)F
C1=CC(=CC=C1COC2=C(C=C(C=C2)Br)C=CC3=C(C(=O)NC(=O)N3)(N+)(=O)(O))F
InChI=1SC19H13BrFN3O5c20134816(2910111514(21)6211)12(913)371517(24(27)28)18(25)2319(26)2215h19H10H2(H222232526)b73+
MFCD04383393
ZINC9235019
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