Vitas-M small molecule compound
2-[(Z)-2-(4-fluorophenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Catalog ID
STK869048
SMILES Oc1nc(/C=C\c2ccc(cc2)F)[nH]c(=O)c1[N+](=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 C12H8FN3O4 MW 277.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H8FN3O4/c13-8-4-1-7(2-5-8)3-6-9-14-11(17)10(16(19)20)12(18)15-9/h1-6H,(H2,14,15,17,18)/b6-3-InChIKey
TUNGEXRREXLTDF-UTCJRWHESA-NSynonyms
(E)2(4fluorostyryl)6hydroxy5nitropyrimidin4(3H)one
2((Z)2(4fluorophenyl)ethenyl)4hydroxy5nitro1Hpyrimidin6one
2((Z)2(4fluorophenyl)ethenyl)6hydroxy5nitropyrimidin4(3H)one
C1=CC(=CC=C1C=CC2=NC(=C(C(=O)N2)(N+)(=O)(O))O)F
InChI=1SC12H8FN3O4c138417(258)3691411(17)10(16(19)20)12(18)159h16H(H214151718)b63
MFCD18170059
Oc1nc(C=Cc2ccc(cc2)F)(nH)c(=O)c1(N+)(=O)(O)
ZINC000016400310
ZINC16400310
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