Vitas-M small molecule compound
2-{(E)-2-[2-(benzyloxy)-4-(diethylamino)phenyl]ethenyl}-5-nitropyrimidine-4,6-diol
Catalog ID
STK613541
SMILES CCN(c1ccc(c(c1)OCc1ccccc1)/C=C/c1nc(O)c(c(n1)O)[N+](=O)[O-])CC
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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 C23H24N4O5 MW 436.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O5/c1-3-26(4-2)18-12-10-17(19(14-18)32-15-16-8-6-5-7-9-16)11-13-20-24-22(28)21(27(30)31)23(29)25-20/h5-14H,3-4,15H2,1-2H3,(H2,24,25,28,29)/b13-11+InChIKey
MJRIRXUNOLFJDQ-ACCUITESSA-NSynonyms
708994-87-02((E)2(2(benzyloxy)4(diethylamino)phenyl)ethenyl)5nitropyrimidine46diol
2((E)2(4(DIETHYLAMINO)2PHENYLMETHOXYPHENYL)ETHENYL)4HYDROXY5NITRO1HPYRIMIDIN6ONE
708994870
CCN(c1ccc(c(c1)OCc1ccccc1)C=Cc1nc(O)c(c(n1)O)(N+)(=O)(O))CC
CCN(CC)C1=CC(=C(C=C1)C=CC2=NC(=C(C(=O)N2)(N+)(=O)(O))O)OCC3=CC=CC=C3
InChI=1SC23H24N4O5c1326(42)18121017(19(1418)3215168657916)1113202422(28)21(27(30)31)23(29)2520h514H3415H212H3(H224252829)b1311+
MFCD08737084
ZINC000009234797
ZINC09234797
ZINC9234797
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