Vitas-M small molecule compound

{5-[(1,3-benzodioxol-5-yloxy)methyl]furan-2-yl}(1H-pyrazol-1-yl)methanone

Catalog ID
STL399352
SMILES O=C(n1cccn1)c1ccc(o1)COc1ccc2c(c1)OCO2

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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 C16H12N2O5 MW 312.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O5/c19-16(18-7-1-6-17-18)14-5-3-12(23-14)9-20-11-2-4-13-15(8-11)22-10-21-13/h1-8H,9-10H2
InChIKey
VWZXXXSEPPZBQQ-UHFFFAOYSA-N
Synonyms
1005564-24-8
(5((13BENZODIOXOL5YLOXY)METHYL)FURAN2YL)(1HPYRAZOL1YL)METHANONE
(5(13BENZODIOXOL5YLOXYMETHYL)FURAN2YL)PYRAZOL1YLMETHANONE
1005564248
C1OC2=C(O1)C=C(C=C2)OCC3=CC=C(O3)C(=O)N4C=CC=N4
InChI=1SC16H12N2O5c1916(187161718)145312(2314)92011241315(811)22102113h18H910H2
MFCD04047294
ZINC000002780170
ZINC02780170
ZINC2780170

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Available files

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