Vitas-M small molecule compound
(1Z)-N'-{[(4-bromo-1-methyl-1H-pyrazol-3-yl)carbonyl]oxy}-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethanimidamide
Catalog ID
STL395359
SMILES N/C(=N\OC(=O)c1nn(cc1Br)C)/Cn1nc(c(c1C)[N+](=O)[O-])C
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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 C12H14BrN7O4 MW 400.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14BrN7O4/c1-6-11(20(22)23)7(2)19(15-6)5-9(14)17-24-12(21)10-8(13)4-18(3)16-10/h4H,5H2,1-3H3,(H2,14,17)InChIKey
IHSGVMCFALMLMZ-UHFFFAOYSA-NSynonyms
1006993-66-3((E)(1amino2(35dimethyl4nitropyrazol1yl)ethylidene)amino)4bromo1methylpyrazole3carboxylate
(1Z)N(((4BROMO1METHYL1HPYRAZOL3YL)CARBONYL)OXY)2(35DIMETHYL4NITRO1HPYRAZOL1YL)ETHANIMIDAMIDE
1006993663
CC1=C(C(=NN1CC(=NOC(=O)C2=NN(C=C2Br)C)N)C)(N+)(=O)(O)
InChI=1SC12H14BrN7O4c1611(20(22)23)7(2)19(156)59(14)172412(21)108(13)418(3)1610h4H5H213H3(H21417)
MFCD08553708
NC(=NOC(=O)c1nn(cc1Br)C)Cn1nc(c(c1C)(N+)(=O)(O))C
ZINC000036612104
ZINC36612104
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