Vitas-M small molecule compound

4-[4-(3,5-diphenyl-1H-pyrazol-1-yl)-6-methyl-5-nitropyrimidin-2-yl]morpholine

Catalog ID
STK537961
SMILES [O-][N+](=O)c1c(C)nc(nc1n1nc(cc1c1ccccc1)c1ccccc1)N1CCOCC1

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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 C24H22N6O3 MW 442.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N6O3/c1-17-22(30(31)32)23(26-24(25-17)28-12-14-33-15-13-28)29-21(19-10-6-3-7-11-19)16-20(27-29)18-8-4-2-5-9-18/h2-11,16H,12-15H2,1H3
InChIKey
LKGZOCXIJUDHIT-UHFFFAOYSA-N
Synonyms
(O)(N+)(=O)c1c(C)nc(nc1n1nc(cc1c1ccccc1)c1ccccc1)N1CCOCC1
4(4(35diphenyl1Hpyrazol1yl)6methyl5nitropyrimidin2yl)morpholine
4(4(35DIPHENYLPYRAZOL1YL)6METHYL5NITROPYRIMIDIN2YL)MORPHOLINE
CC1=C(C(=NC(=N1)N2CCOCC2)N3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)(N+)(=O)(O)
Registry IDs
MFCD02990878
ZINC000009043831
ZINC09043831
ZINC9043831

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.