Vitas-M small molecule compound
{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}(4-ethoxy-3-nitrophenyl)methanone
Catalog ID
STK019628
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[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 C24H26N6O6 MW 494.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N6O6/c1-4-36-23-8-5-18(14-22(23)30(34)35)24(31)27-11-9-26(10-12-27)19-6-7-20(29(32)33)21(15-19)28-17(3)13-16(2)25-28/h5-8,13-15H,4,9-12H2,1-3H3InChIKey
BHJPLAXEDWBVGB-UHFFFAOYSA-NSynonyms
(4(3(35DIMETHYL1HPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)(4ETHOXY3NITROPHENYL)METHANONE
(4(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)(4ETHOXY3NITROPHENYL)METHANONE
CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4C(=CC(=N4)C)C)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)(N+)(=O)(O)
InChI=1SC24H26N6O6c1436238518(1422(23)30(34)35)24(31)2711926(101227)196720(29(32)33)21(1519)2817(3)1316(2)2528h581315H4912H213H3
MFCD02627901
STK019628
ZINC000008986364
ZINC08986364
ZINC8986364
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.