Vitas-M small molecule compound
(2Z)-1-(1,3-benzodioxol-5-yl)-3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Catalog ID
STK307175
SMILES CCn1nc(c(c1)/C=C\C(=O)c1ccc2c(c1)OCO2)C
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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/c1-3-18-9-13(11(2)17-18)4-6-14(19)12-5-7-15-16(8-12)21-10-20-15/h4-9H,3,10H2,1-2H3/b6-4-InChIKey
WAJJUUJVHBDXEA-XQRVVYSFSA-NSynonyms
1005704-15-3(2Z)1(13benzodioxol5yl)3(1ethyl3methyl1Hpyrazol4yl)prop2en1one
(Z)1(13benzodioxol5yl)3(1ethyl3methylpyrazol4yl)prop2en1one
1005704153
CCN1C=C(C(=N1)C)C=CC(=O)C2=CC3=C(C=C2)OCO3
CCn1nc(c(c1)C=CC(=O)c1ccc2c(c1)OCO2)C
InChI=1SC16H16N2O3c1318913(11(2)1718)4614(19)12571516(812)21102015h49H310H212H3b64
MFCD04052015
ZINC000006490222
ZINC06490222
ZINC6490222
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Check stock on Vitas-MAvailable files
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