Vitas-M small molecule compound

(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)(2-chloro-5-nitrophenyl)methanone

Catalog ID
STL356308
SMILES Clc1ccc(cc1C(=O)n1nc(c(c1C)Br)C)[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 C12H9BrClN3O3 MW 358.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9BrClN3O3/c1-6-11(13)7(2)16(15-6)12(18)9-5-8(17(19)20)3-4-10(9)14/h3-5H,1-2H3
InChIKey
GGPUIFKDHLJARS-UHFFFAOYSA-N
Synonyms
360784-47-0
(4bromo35dimethyl1Hpyrazol1yl)(2chloro5nitrophenyl)methanone
(4BROMO35DIMETHYLPYRAZOL1YL)(2CHLORO5NITROPHENYL)METHANONE
360784470
4BROMO1(2CHLORO5NITROBENZOYL)35DIMETHYL1HPYRAZOLE
4BROMO35DIMETHYLPYRAZOLYL2CHLORO5NITROPHENYLKETONE
CC1=C(C(=NN1C(=O)C2=C(C=CC(=C2)(N+)(=O)(O))Cl)C)Br
Clc1ccc(cc1C(=O)n1nc(c(c1C)Br)C)(N+)(=O)(O)
InChI=1SC12H9BrClN3O3c1611(13)7(2)16(156)12(18)958(17(19)20)3410(9)14h35H12H3
METHANONE(4BROMO35DIMETHYL1PYRAZOLYL)(2CHLORO5NITROPHENYL)
MFCD02631269
ZINC000001085584
ZINC01085584
ZINC1085584

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Available files

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