Vitas-M small molecule compound
6-{(E)-2-[4-(diethylamino)-3-nitrophenyl]ethenyl}-5-nitropyrimidine-2,4-diol
Catalog ID
STK535300
SMILES CCN(c1ccc(cc1[N+](=O)[O-])/C=C/c1nc(O)nc(c1[N+](=O)[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 C16H17N5O6 MW 375.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O6/c1-3-19(4-2)12-8-6-10(9-13(12)20(24)25)5-7-11-14(21(26)27)15(22)18-16(23)17-11/h5-9H,3-4H2,1-2H3,(H2,17,18,22,23)/b7-5+InChIKey
QBWZJDXZTUELID-FNORWQNLSA-NSynonyms
(E)6(4(diethylamino)3nitrostyryl)5nitropyrimidine24diol
6((E)2(4(DIETHYLAMINO)3NITROPHENYL)ETHENYL)5NITRO1HPYRIMIDINE24DIONE
6((E)2(4(diethylamino)3nitrophenyl)ethenyl)5nitropyrimidine24diol
CCN(c1ccc(cc1(N+)(=O)(O))C=Cc1nc(O)nc(c1(N+)(=O)(O))O)CC
CCN(CC)C1=C(C=C(C=C1)C=CC2=C(C(=O)NC(=O)N2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H17N5O6c1319(42)128610(913(12)20(24)25)571114(21(26)27)15(22)1816(23)1711h59H34H212H3(H217182223)b75+
MFCD01827573
ZINC000009186594
ZINC9186594
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