Vitas-M small molecule compound
(4E)-5-methyl-4-[2-(4-methyl-3-nitrophenyl)hydrazinylidene]-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK084559
SMILES CC1=NN(C(=O)/C/1=N/Nc1ccc(c(c1)[N+](=O)[O-])C)c1ccc(cc1)[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 C17H14N6O5 MW 382.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N6O5/c1-10-3-4-12(9-15(10)23(27)28)18-19-16-11(2)20-21(17(16)24)13-5-7-14(8-6-13)22(25)26/h3-9,18H,1-2H3/b19-16+InChIKey
RWDCOJYHKUBXGN-KNTRCKAVSA-NSynonyms
(4E)5METHYL4((4METHYL3NITROPHENYL)HYDRAZINYLIDENE)2(4NITROPHENYL)PYRAZOL3ONE
(4E)5METHYL4(2(4METHYL3NITROPHENYL)HYDRAZINYLIDENE)2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
CC1=C(C=C(C=C1)NN=C2C(=NN(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))C)(N+)(=O)(O)
CC1=NN(C(=O)C1=NNc1ccc(c(c1)(N+)(=O)(O))C)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H14N6O5c1103412(915(10)23(27)28)18191611(2)2021(17(16)24)135714(8613)22(25)26h3918H12H3b1916+
MFCD01418871
STK084559
ZINC000009679078
ZINC100532664
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