Vitas-M small molecule compound

(2Z)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-ethyl-1H-pyrazol-4-yl)prop-2-en-1-one

Catalog ID
STK306920
SMILES CCn1ncc(c1)/C=C\C(=O)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 C16H16N2O3 MW 284.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O3/c1-2-18-11-12(10-17-18)3-5-14(19)13-4-6-15-16(9-13)21-8-7-20-15/h3-6,9-11H,2,7-8H2,1H3/b5-3-
InChIKey
HPEGHBALLNOXST-HYXAFXHYSA-N
Synonyms
1005609-63-1
(2Z)1(23dihydro14benzodioxin6yl)3(1ethyl1Hpyrazol4yl)prop2en1one
(Z)1(23dihydro14benzodioxin6yl)3(1ethylpyrazol4yl)prop2en1one
1005609631
CCN1C=C(C=N1)C=CC(=O)C2=CC3=C(C=C2)OCCO3
CCn1ncc(c1)C=CC(=O)c1ccc2c(c1)OCCO2
InChI=1SC16H16N2O3c12181112(101718)3514(19)13461516(913)21872015h36911H278H21H3b53
MFCD04053490
ZINC000006490293
ZINC06490293
ZINC6490293

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Available files

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