Vitas-M small molecule compound
1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-3,5-dimethyl-4-nitro-1H-pyrazole
Catalog ID
STK723089
SMILES COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)/C=N/Nc1ccccc1
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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 C20H21N5O3 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3/c1-14-20(25(26)27)15(2)24(23-14)13-17-11-16(9-10-19(17)28-3)12-21-22-18-7-5-4-6-8-18/h4-12,22H,13H2,1-3H3/b21-12+InChIKey
HBKSRVAUKHJJIZ-CIAFOILYSA-NSynonyms
304653-45-0(E)1(2methoxy5((2phenylhydrazono)methyl)benzyl)35dimethyl4nitro1Hpyrazole
1(2methoxy5((E)(2phenylhydrazinylidene)methyl)benzyl)35dimethyl4nitro1Hpyrazole
304653450
CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NNC3=CC=CC=C3)OC)C)(N+)(=O)(O)
COc1ccc(cc1Cn1nc(c(c1C)(N+)(=O)(O))C)C=NNc1ccccc1
InChI=1SC20H21N5O3c11420(25(26)27)15(2)24(2314)13171116(91019(17)283)122122187546818h41222H13H213H3b2112+
MFCD01564878
N((E)(3((35dimethyl4nitropyrazol1yl)methyl)4methoxyphenyl)methylideneamino)aniline
N(1(3(35DIMETHYL4NITROPYRAZOL1YLMETHYL)4METHOXYPHENYL)METH(E)YLIDENE)NPHENYLHYDRAZINE
ZINC000004785970
ZINC35145761
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