Vitas-M small molecule compound

N'-{(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-nitrobenzohydrazide

Catalog ID
STL295169
SMILES Cc1ccc(cc1)N1N=C(/C(=C/NNC(=O)c2ccccc2[N+](=O)[O-])/C1=O)C

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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 C19H17N5O4 MW 379.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O4/c1-12-7-9-14(10-8-12)23-19(26)16(13(2)22-23)11-20-21-18(25)15-5-3-4-6-17(15)24(27)28/h3-11,20H,1-2H3,(H,21,25)/b16-11-
InChIKey
ZZDANSXEMKHBNR-WJDWOHSUSA-N
Synonyms

CC1=CC=C(C=C1)N2C(=O)C(=CNNC(=O)C3=CC=CC=C3(N+)(=O)(O))C(=N2)C
Cc1ccc(cc1)N1N=C(C(=CNNC(=O)c2ccccc2(N+)(=O)(O))C1=O)C
InChI=1SC19H17N5O4c1127914(10812)2319(26)16(13(2)2223)11202118(25)15534617(15)24(27)28h31120H12H3(H2125)b1611
MFCD00746745
N(((3METHYL1(4METHYLPHENYL)5OXO(12DIAZOLIN4YLIDENE))METHYL)AMINO)(2NITROPHENYL)CARBOXAMIDE
N((Z)(3methyl1(4methylphenyl)5oxo15dihydro4Hpyrazol4ylidene)methyl)2nitrobenzohydrazide
N((Z)(3METHYL1(4METHYLPHENYL)5OXOPYRAZOL4YLIDENE)METHYL)2NITROBENZOHYDRAZIDE
ZINC000005339786
ZINC05339786
ZINC5339786

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Available files

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