Vitas-M small molecule compound
6-[(E)-2-(3-ethoxy-4-propoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol
Catalog ID
STL367330
SMILES CCCOc1ccc(cc1OCC)/C=C/c1nc(O)nc(c1[N+](=O)[O-])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 C17H19N3O6 MW 361.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O6/c1-3-9-26-13-8-6-11(10-14(13)25-4-2)5-7-12-15(20(23)24)16(21)19-17(22)18-12/h5-8,10H,3-4,9H2,1-2H3,(H2,18,19,21,22)/b7-5+InChIKey
JYIXTFKPEWDRJT-FNORWQNLSA-NSynonyms
6((1E)2(3ETHOXY4PROPOXYPHENYL)VINYL)5NITRO13DIHYDROPYRIMIDINE24DIONE
6((E)2(3ETHOXY4PROPOXYPHENYL)ETHENYL)5NITRO1HPYRIMIDINE24DIONE
6((E)2(3ethoxy4propoxyphenyl)ethenyl)5nitropyrimidine24diol
6((E)2(3ETHOXY4PROPOXYPHENYL)VINYL)5NITRO1HPYRIMIDINE24DIONE
CCCOC1=C(C=C(C=C1)C=CC2=C(C(=O)NC(=O)N2)(N+)(=O)(O))OCC
CCCOc1ccc(cc1OCC)C=Cc1nc(O)nc(c1(N+)(=O)(O))O
InChI=1SC17H19N3O6c13926138611(1014(13)2542)571215(20(23)24)16(21)1917(22)1812h5810H349H212H3(H218192122)b75+
MFCD28951750
ZINC000004501650
ZINC4501650
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