Vitas-M small molecule compound
2-{2-ethoxy-4-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1,6-dihydropyrimidin-2-yl)ethenyl]phenoxy}acetamide
Catalog ID
STL358779
SMILES CCOc1cc(/C=C/c2nc(O)c(c(=O)[nH]2)[N+](=O)[O-])ccc1OCC(=O)N
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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 C16H16N4O7 MW 376.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O7/c1-2-26-11-7-9(3-5-10(11)27-8-12(17)21)4-6-13-18-15(22)14(20(24)25)16(23)19-13/h3-7H,2,8H2,1H3,(H2,17,21)(H2,18,19,22,23)/b6-4+InChIKey
DXMKLFGKVCUAFE-GQCTYLIASA-NSynonyms
2(2ethoxy4((E)2(4hydroxy5nitro6oxo16dihydropyrimidin2yl)ethenyl)phenoxy)acetamide
2(2ETHOXY4((E)2(4HYDROXY5NITRO6OXO1HPYRIMIDIN2YL)ETHENYL)PHENOXY)ACETAMIDE
CCOC1=C(C=CC(=C1)C=CC2=NC(=C(C(=O)N2)(N+)(=O)(O))O)OCC(=O)N
CCOc1cc(C=Cc2nc(O)c(c(=O)(nH)2)(N+)(=O)(O))ccc1OCC(=O)N
InChI=1SC16H16N4O7c12261179(3510(11)27812(17)21)46131815(22)14(20(24)25)16(23)1913h37H28H21H3(H21721)(H218192223)b64+
MFCD05993896
ZINC000009234843
ZINC9234843
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