Vitas-M small molecule compound

4-chloro-1,3-dimethyl-N'-[(E)-(2-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide

Catalog ID
STK960261
SMILES O=C(c1n(C)nc(c1Cl)C)N/N=C/c1ccccc1[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 C13H12ClN5O3 MW 321.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12ClN5O3/c1-8-11(14)12(18(2)17-8)13(20)16-15-7-9-5-3-4-6-10(9)19(21)22/h3-7H,1-2H3,(H,16,20)/b15-7+
InChIKey
TXJGGPNGZXWKRK-VIZOYTHASA-N
Synonyms
515149-21-0
4chloro13dimethylN((E)(2nitrophenyl)methylidene)1Hpyrazole5carbohydrazide
4CHLORO25DIMETHYLN((E)(2NITROPHENYL)METHYLIDENEAMINO)PYRAZOLE3CARBOXAMIDE
4CHLORON(2NITROBENZYLIDENE)13DIMETHYL1HPYRAZOLE5CARBOHYDRAZIDE
515149210
CC1=NN(C(=C1Cl)C(=O)NN=CC2=CC=CC=C2(N+)(=O)(O))C
InChI=1SC13H12ClN5O3c1811(14)12(18(2)178)13(20)161579534610(9)19(21)22h37H12H3(H1620)b157+
MFCD02607480
O=C(c1n(C)nc(c1Cl)C)NN=Cc1ccccc1(N+)(=O)(O)
ZINC000000371432
ZINC33309792

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Available files

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