Vitas-M small molecule compound
(2Z)-1-(1,3-benzodioxol-5-yl)-3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Catalog ID
STK307132
SMILES CCn1ncc(c1C)/C=C\C(=O)c1ccc2c(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 C16H16N2O3 MW 284.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O3/c1-3-18-11(2)13(9-17-18)4-6-14(19)12-5-7-15-16(8-12)21-10-20-15/h4-9H,3,10H2,1-2H3/b6-4-InChIKey
KSMPWTJTTFLEPA-XQRVVYSFSA-NSynonyms
1005635-51-7(2Z)1(13benzodioxol5yl)3(1ethyl5methyl1Hpyrazol4yl)prop2en1one
(Z)1(13benzodioxol5yl)3(1ethyl5methylpyrazol4yl)prop2en1one
1005635517
CCN1C(=C(C=N1)C=CC(=O)C2=CC3=C(C=C2)OCO3)C
CCn1ncc(c1C)C=CC(=O)c1ccc2c(c1)OCO2
InChI=1SC16H16N2O3c131811(2)13(91718)4614(19)12571516(812)21102015h49H310H212H3b64
MFCD04052016
ZINC000006490031
ZINC06490031
ZINC6490031
Check stock
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Check stock on Vitas-MAvailable files
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