Vitas-M small molecule compound
5-{[5-(3-chloro-4-nitrophenyl)furan-2-yl]methylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK759902
SMILES CN1C(=O)N(C)C(=O)C(=Cc2ccc(o2)c2ccc(c(c2)Cl)[N+](=O)[O-])C1=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 C17H12ClN3O6 MW 389.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClN3O6/c1-19-15(22)11(16(23)20(2)17(19)24)8-10-4-6-14(27-10)9-3-5-13(21(25)26)12(18)7-9/h3-8H,1-2H3InChIKey
YWNKRDWTILRHBT-UHFFFAOYSA-NSynonyms
5((5(3CHLORO4NITROPHENYL)FURAN2YL)METHYLIDENE)13DIMETHYL13DIAZINANE246TRIONE
5((5(3chloro4nitrophenyl)furan2yl)methylidene)13dimethylpyrimidine246(1H3H5H)trione
CN1C(=O)C(=CC2=CC=C(O2)C3=CC(=C(C=C3)(N+)(=O)(O))Cl)C(=O)N(C1=O)C
CN1C(=O)N(C)C(=O)C(=Cc2ccc(o2)c2ccc(c(c2)Cl)(N+)(=O)(O))C1=O
InChI=1SC17H12ClN3O6c11915(22)11(16(23)20(2)17(19)24)8104614(2710)93513(21(25)26)12(18)79h38H12H3
MFCD01456772
ZINC000003668686
ZINC03668686
ZINC3668686
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