Vitas-M small molecule compound

1,1'-[1-(2,5-dimethoxyphenyl)-5-methyl-1H-pyrazole-3,4-diyl]diethanone

Catalog ID
STK699148
SMILES COc1ccc(c(c1)n1nc(c(c1C)C(=O)C)C(=O)C)OC

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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 C16H18N2O4 MW 302.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O4/c1-9-15(10(2)19)16(11(3)20)17-18(9)13-8-12(21-4)6-7-14(13)22-5/h6-8H,1-5H3
InChIKey
BJGXVYFBZPHVAU-UHFFFAOYSA-N
Synonyms
1013816-92-6
1(3acetyl1(25dimethoxyphenyl)5methylpyrazol4yl)ethanone
1013816926
11(1(25dimethoxyphenyl)5methyl1Hpyrazole34diyl)diethanone
34DIACETYL1(25DIMETHOXYPHENYL)5METHYLPYRAZOLE
CC1=C(C(=NN1C2=C(C=CC(=C2)OC)OC)C(=O)C)C(=O)C
InChI=1SC16H18N2O4c1915(10(2)19)16(11(3)20)1718(9)13812(214)6714(13)225h68H15H3
MFCD11843480
ZINC000012321427
ZINC12321427

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.