Vitas-M small molecule compound
(2Z)-1-(1,3-benzodioxol-5-yl)-3-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one
Catalog ID
STK306628
SMILES O=C(c1ccc2c(c1)OCO2)/C=C\c1ccnn1C
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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 C14H12N2O3 MW 256.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O3/c1-16-11(6-7-15-16)3-4-12(17)10-2-5-13-14(8-10)19-9-18-13/h2-8H,9H2,1H3/b4-3-InChIKey
LHOKCFBBUJAHPI-ARJAWSKDSA-NSynonyms
1005629-55-9(2Z)1(13benzodioxol5yl)3(1methyl1Hpyrazol5yl)prop2en1one
(Z)1(13benzodioxol5yl)3(2methylpyrazol3yl)prop2en1one
1005629559
CN1C(=CC=N1)C=CC(=O)C2=CC3=C(C=C2)OCO3
InChI=1SC14H12N2O3c11611(671516)3412(17)10251314(810)1991813h28H9H21H3b43
MFCD04052018
O=C(c1ccc2c(c1)OCO2)C=Cc1ccnn1C
ZINC000006827505
ZINC06827505
ZINC6827505
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