Vitas-M small molecule compound
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(4-iodo-1H-pyrazol-1-yl)ethanone
Catalog ID
STK781972
SMILES Ic1cnn(c1)C(=O)Cn1nc(c(c1C)Br)[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 C9H7BrIN5O3 MW 439.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7BrIN5O3/c1-5-8(10)9(16(18)19)13-14(5)4-7(17)15-3-6(11)2-12-15/h2-3H,4H2,1H3InChIKey
VMWMTFSYOZMNMB-UHFFFAOYSA-NSynonyms
2(4bromo5methyl3nitro1Hpyrazol1yl)1(4iodo1Hpyrazol1yl)ethanone
2(4BROMO5METHYL3NITROPYRAZOL1YL)1(4IODOPYRAZOL1YL)ETHANONE
CC1=C(C(=NN1CC(=O)N2C=C(C=N2)I)(N+)(=O)(O))Br
Ic1cnn(c1)C(=O)Cn1nc(c(c1C)Br)(N+)(=O)(O)
InChI=1SC9H7BrIN5O3c158(10)9(16(18)19)1314(5)47(17)1536(11)21215h23H4H21H3
MFCD06016265
ZINC000012372258
ZINC12372258
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