Vitas-M small molecule compound
(1-ethyl-4-nitro-1H-pyrazol-3-yl)[(7E)-7-(4-nitrobenzylidene)-3-(4-nitrophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Catalog ID
STK302258
SMILES CCn1cc(c(n1)C(=O)N1N=C2C(C1c1ccc(cc1)[N+](=O)[O-])CCC/C/2=C\c1ccc(cc1)[N+](=O)[O-])[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 C26H23N7O7 MW 545.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N7O7/c1-2-29-15-22(33(39)40)24(27-29)26(34)30-25(17-8-12-20(13-9-17)32(37)38)21-5-3-4-18(23(21)28-30)14-16-6-10-19(11-7-16)31(35)36/h6-15,21,25H,2-5H2,1H3/b18-14+InChIKey
IDZVZPIAZPZAGG-NBVRZTHBSA-NSynonyms
512817-22-0(1ethyl4nitro1Hpyrazol3yl)((7E)7(4nitrobenzylidene)3(4nitrophenyl)33a4567hexahydro2Hindazol2yl)methanone
(1ETHYL4NITROPYRAZOL3YL)((7E)3(4NITROPHENYL)7((4NITROPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)METHANONE
512817220
CCN1C=C(C(=N1)C(=O)N2C(C3CCCC(=CC4=CC=C(C=C4)(N+)(=O)(O))C3=N2)C5=CC=C(C=C5)(N+)(=O)(O))(N+)(=O)(O)
CCn1cc(c(n1)C(=O)N1N=C2C(C1c1ccc(cc1)(N+)(=O)(O))CCCC2=Cc1ccc(cc1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC26H23N7O7c12291522(33(39)40)24(2729)26(34)3025(1781220(13917)32(37)38)2153418(23(21)2830)141661019(11716)31(35)36h6152125H25H21H3b1814+
MFCD03467957
ZINC000008455428
ZINC000008455431
Check stock
See real-time availability and sample size for STK302258 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.