Vitas-M small molecule compound
N-[(E)-(2-chloro-5-nitrophenyl)methylidene]-3-(3,5-dimethyl-1H-pyrazol-1-yl)-4H-1,2,4-triazol-4-amine
Catalog ID
STK767179
SMILES Cc1nn(c(c1)C)c1nncn1/N=C/c1cc(ccc1Cl)[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 C14H12ClN7O2 MW 345.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClN7O2/c1-9-5-10(2)21(19-9)14-18-16-8-20(14)17-7-11-6-12(22(23)24)3-4-13(11)15/h3-8H,1-2H3/b17-7+InChIKey
QABVFKQLPFDUJX-REZTVBANSA-NSynonyms
(E)1(2chloro5nitrophenyl)N(3(35dimethylpyrazol1yl)124triazol4yl)methanimine
4((2CHLORO5NITROBENZYLIDENE)AMINO)3(35DIMETHYL1HPYRAZOL1YL)4H124TRIAZOLE
CC1=CC(=NN1C2=NN=CN2N=CC3=C(C=CC(=C3)(N+)(=O)(O))Cl)C
Cc1nn(c(c1)C)c1nncn1N=Cc1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC14H12ClN7O2c19510(2)21(199)141816820(14)17711612(22(23)24)3413(11)15h38H12H3b177+
MFCD03036794
N((E)(2chloro5nitrophenyl)methylidene)3(35dimethyl1Hpyrazol1yl)4H124triazol4amine
ZINC000000092093
ZINC33285977
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