Vitas-M small molecule compound

4-{(E)-[(2-methoxyethyl)imino]methyl}-2-(4-nitrophenyl)-5-propyl-1,2-dihydro-3H-pyrazol-3-one

Catalog ID
STK957637
SMILES CCCc1[nH]n(c(=O)c1/C=N/CCOC)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 C16H20N4O4 MW 332.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O4/c1-3-4-15-14(11-17-9-10-24-2)16(21)19(18-15)12-5-7-13(8-6-12)20(22)23/h5-8,11,18H,3-4,9-10H2,1-2H3/b17-11+
InChIKey
YGLKXFPAANEUKR-GZTJUZNOSA-N
Synonyms
371956-52-4
371956524
4((E)((2methoxyethyl)imino)methyl)2(4nitrophenyl)5propyl12dihydro3Hpyrazol3one
CCCc1(nH)n(c(=O)c1C=NCCOC)c1ccc(cc1)(N+)(=O)(O)
MFCD01919287
ZINC000018037441

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Available files

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