Vitas-M small molecule compound
2-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenoxy}-N-[2-(propan-2-yl)phenyl]acetamide
Catalog ID
STL367258
SMILES O=C(Nc1ccccc1C(C)C)COc1ccc(cc1)/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 C23H22N4O6 MW 450.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O6/c1-14(2)17-5-3-4-6-18(17)24-20(28)13-33-16-10-7-15(8-11-16)9-12-19-21(27(31)32)22(29)26-23(30)25-19/h3-12,14H,13H2,1-2H3,(H,24,28)(H2,25,26,29,30)/b12-9+InChIKey
NUUCVZNRXQDTHM-FMIVXFBMSA-NSynonyms
2(4((E)2(26dihydroxy5nitropyrimidin4yl)ethenyl)phenoxy)N(2(propan2yl)phenyl)acetamide
2(4((E)2(5NITRO24DIOXO1HPYRIMIDIN6YL)ETHENYL)PHENOXY)N(2PROPAN2YLPHENYL)ACETAMIDE
InChI=1SC23H22N4O6c114(2)17534618(17)2420(28)13331610715(81116)9121921(27(31)32)22(29)2623(30)2519h31214H13H212H3(H2428)(H225262930)b129+
MFCD28951692
O=C(Nc1ccccc1C(C)C)COc1ccc(cc1)C=Cc1nc(O)nc(c1(N+)(=O)(O))O
ZINC000009234628
ZINC9234628
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