Vitas-M small molecule compound

3-[1,5-bis(4-nitrophenyl)-1H-pyrazol-3-yl]-6-bromo-2H-chromen-2-one

Catalog ID
STL323183
SMILES Brc1ccc2c(c1)cc(c(=O)o2)c1cc(n(n1)c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[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 C24H13BrN4O6 MW 533.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H13BrN4O6/c25-16-3-10-23-15(11-16)12-20(24(30)35-23)21-13-22(14-1-4-18(5-2-14)28(31)32)27(26-21)17-6-8-19(9-7-17)29(33)34/h1-13H
InChIKey
NPTQKYKBIVDJGK-UHFFFAOYSA-N
Synonyms
311809-84-4
3(15bis(4nitrophenyl)1Hpyrazol3yl)6bromo2Hchromen2one
3(15BIS(4NITROPHENYL)PYRAZOL3YL)6BROMOCHROMEN2ONE
311809844
Brc1ccc2c(c1)cc(c(=O)o2)c1cc(n(n1)c1ccc(cc1)(N+)(=O)(O))c1ccc(cc1)(N+)(=O)(O)
C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)(N+)(=O)(O))C4=CC5=C(C=CC(=C5)Br)OC4=O)(N+)(=O)(O)
InChI=1SC24H13BrN4O6c25163102315(1116)1220(24(30)3523)211322(141418(5214)28(31)32)27(2621)176819(9717)29(33)34h113H
MFCD00775210
ZINC000002323103
ZINC2323103

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Available files

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