Vitas-M small molecule compound

1-{4-[2-({(E)-[5-hydroxy-1-(4-nitrophenyl)-3-phenyl-1H-pyrazol-4-yl]methylidene}amino)ethyl]piperazin-1-yl}propan-1-one

Catalog ID
STK633047
SMILES CCC(=O)N1CCN(CC1)CC/N=C/c1c(nn(c1O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

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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 C25H28N6O4 MW 476.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O4/c1-2-23(32)29-16-14-28(15-17-29)13-12-26-18-22-24(19-6-4-3-5-7-19)27-30(25(22)33)20-8-10-21(11-9-20)31(34)35/h3-11,18,33H,2,12-17H2,1H3/b26-18+
InChIKey
HGTTWOXJLDCATN-NLRVBDNBSA-N
Synonyms

1(4(2(((E)(5hydroxy1(4nitrophenyl)3phenyl1Hpyrazol4yl)methylidene)amino)ethyl)piperazin1yl)propan1one
CCC(=O)N1CCN(CC1)CCN=Cc1c(nn(c1O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
MFCD18159974
ZINC000096786322

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Available files

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