Vitas-M small molecule compound
(4E)-4-[2-(4-methoxy-2-nitrophenyl)hydrazinylidene]-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK061700
SMILES COc1ccc(c(c1)[N+](=O)[O-])N/N=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C
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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 C17H14N6O6 MW 398.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N6O6/c1-10-16(19-18-14-8-7-13(29-2)9-15(14)23(27)28)17(24)21(20-10)11-3-5-12(6-4-11)22(25)26/h3-9,18H,1-2H3/b19-16+InChIKey
JPPZUFIKUUOUIW-KNTRCKAVSA-NSynonyms
(4E)4((4methoxy2nitrophenyl)hydrazinylidene)5methyl2(4nitrophenyl)pyrazol3one
(4E)4(2(4METHOXY2NITROPHENYL)HYDRAZINYLIDENE)5METHYL2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
CC1=NN(C(=O)C1=NNC2=C(C=C(C=C2)OC)(N+)(=O)(O))C3=CC=C(C=C3)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))NN=C1C(=NN(C1=O)c1ccc(cc1)(N+)(=O)(O))C
InChI=1SC17H14N6O6c11016(1918148713(292)915(14)23(27)28)17(24)21(2010)113512(6411)22(25)26h3918H12H3b1916+
MFCD01418873
STK061700
ZINC000100005566
ZINC08398168
ZINC8398168
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