Vitas-M small molecule compound
1,1'-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1H-pyrazole-3,4-diyl]diethanone
Catalog ID
STK805200
SMILES CC(=O)c1nn(c(c1C(=O)C)C)c1ccc2c(c1)OCCO2
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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 C16H16N2O4 MW 300.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O4/c1-9-15(10(2)19)16(11(3)20)17-18(9)12-4-5-13-14(8-12)22-7-6-21-13/h4-5,8H,6-7H2,1-3H3InChIKey
NLLOSXCTTLMRDG-UHFFFAOYSA-NSynonyms
1013804-95-91(3acetyl1(23dihydro14benzodioxin6yl)5methylpyrazol4yl)ethanone
1013804959
11(1(23dihydro14benzodioxin6yl)5methyl1Hpyrazole34diyl)diethanone
11(1(23dihydrobenzo(b)(14)dioxin6yl)5methyl1Hpyrazole34diyl)diethanone
CC1=C(C(=NN1C2=CC3=C(C=C2)OCCO3)C(=O)C)C(=O)C
InChI=1SC16H16N2O4c1915(10(2)19)16(11(3)20)1718(9)12451314(812)22762113h458H67H213H3
MFCD11843356
ZINC000012322443
ZINC12322443
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