Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Catalog ID
STL433928
SMILES O=CN1N=C(CC1c1cc(OC)c(c(c1)OC)OC)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 C20H20N2O6 MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O6/c1-24-18-7-13(8-19(25-2)20(18)26-3)15-9-14(21-22(15)10-23)12-4-5-16-17(6-12)28-11-27-16/h4-8,10,15H,9,11H2,1-3H3InChIKey
XYKRNAKYHAEBFG-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)5(345trimethoxyphenyl)45dihydro1Hpyrazole1carbaldehyde
3BENZO(13)DIOXOL5YL5(345TRIMETHOXYPHENYL)45DIHYDROPYRAZOLE1CARBALDEHYDE
5(13BENZODIOXOL5YL)3(345TRIMETHOXYPHENYL)34DIHYDROPYRAZOLE2CARBALDEHYDE
COC1=CC(=CC(=C1OC)OC)C2CC(=NN2C=O)C3=CC4=C(C=C3)OCO4
InChI=1SC20H20N2O6c12418713(819(252)20(18)263)15914(2122(15)1023)12451617(612)28112716h481015H911H213H3
MFCD26098186
ZINC000078549315
ZINC000078549321
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