Vitas-M small molecule compound
2-{(E)-2-[5-(2-fluorophenyl)furan-2-yl]ethenyl}-6-hydroxy-5-nitropyrimidin-4(3H)-one
Catalog ID
STK743980
SMILES Fc1ccccc1c1ccc(o1)/C=C/c1nc(O)c(c(=O)[nH]1)[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 C16H10FN3O5 MW 343.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10FN3O5/c17-11-4-2-1-3-10(11)12-7-5-9(25-12)6-8-13-18-15(21)14(20(23)24)16(22)19-13/h1-8H,(H2,18,19,21,22)/b8-6+InChIKey
PMALAPWAAHFVJV-SOFGYWHQSA-NSynonyms
2((E)2(5(2FLUOROPHENYL)FURAN2YL)ETHENYL)4HYDROXY5NITRO1HPYRIMIDIN6ONE
2((E)2(5(2fluorophenyl)furan2yl)ethenyl)6hydroxy5nitropyrimidin4(3H)one
C1=CC=C(C(=C1)C2=CC=C(O2)C=CC3=NC(=C(C(=O)N3)(N+)(=O)(O))O)F
Fc1ccccc1c1ccc(o1)C=Cc1nc(O)c(c(=O)(nH)1)(N+)(=O)(O)
InChI=1SC16H10FN3O5c1711421310(11)12759(2512)68131815(21)14(20(23)24)16(22)1913h18H(H218192122)b86+
MFCD06017322
ZINC000012375681
ZINC12375681
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