Vitas-M small molecule compound

N'-[(E)-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]-3-nitrobenzohydrazide

Catalog ID
STK409793
SMILES COc1ccc(cc1Cn1nc(c(c1C)Br)C)/C=N/NC(=O)c1cccc(c1)[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 C21H20BrN5O4 MW 486.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrN5O4/c1-13-20(22)14(2)26(25-13)12-17-9-15(7-8-19(17)31-3)11-23-24-21(28)16-5-4-6-18(10-16)27(29)30/h4-11H,12H2,1-3H3,(H,24,28)/b23-11+
InChIKey
LYLLBPVNKVTKGU-FOKLQQMPSA-N
Synonyms
944780-87-4
(E)N(3((4bromo35dimethyl1Hpyrazol1yl)methyl)4methoxybenzylidene)3nitrobenzohydrazide
944780874
CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NNC(=O)C3=CC(=CC=C3)(N+)(=O)(O))OC)C)Br
COc1ccc(cc1Cn1nc(c(c1C)Br)C)C=NNC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC21H20BrN5O4c11320(22)14(2)26(2513)1217915(7819(17)313)11232421(28)1654618(1016)27(29)30h411H12H213H3(H2428)b2311+
MFCD03676136
N((E)(3((4bromo35dimethyl1Hpyrazol1yl)methyl)4methoxyphenyl)methylidene)3nitrobenzohydrazide
N((E)(3((4BROMO35DIMETHYLPYRAZOL1YL)METHYL)4METHOXYPHENYL)METHYLIDENEAMINO)3NITROBENZAMIDE
ZINC000002215334
ZINC33350648

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Available files

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