Vitas-M small molecule compound

ethyl 5-({4-[(Z)-{2-[(2-hydroxyphenyl)carbonyl]hydrazinylidene}methyl]-6,7-dimethoxy-1,3-benzodioxol-5-yl}methyl)-4,5-dihydro-1,2-oxazole-3-carboxylate

Catalog ID
STK692975
SMILES CCOC(=O)C1=NOC(C1)Cc1c(/C=N\NC(=O)c2ccccc2O)c2OCOc2c(c1OC)OC

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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 C24H25N3O9 MW 499.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O9/c1-4-33-24(30)17-10-13(36-27-17)9-15-16(11-25-26-23(29)14-7-5-6-8-18(14)28)20-22(35-12-34-20)21(32-3)19(15)31-2/h5-8,11,13,28H,4,9-10,12H2,1-3H3,(H,26,29)/b25-11-
InChIKey
QQRQTYDKAJRIHH-GATIEOLUSA-N
Synonyms

CCOC(=O)C1=NOC(C1)Cc1c(C=NNC(=O)c2ccccc2O)c2OCOc2c(c1OC)OC
CCOC(=O)C1=NOC(C1)CC2=C(C3=C(C(=C2OC)OC)OCO3)C=NNC(=O)C4=CC=CC=C4O
ETHYL5((4((1Z)2((2HYDROXYPHENYL)CARBONYLAMINO)2AZAVINYL)67DIMETHOXY2HBENZO(34D)13DIOXOLAN5YL)METHYL)45DIHYDROISOXAZOLE3CARBOXYLATE
ethyl5((4((Z)((2hydroxybenzoyl)hydrazinylidene)methyl)67dimethoxy13benzodioxol5yl)methyl)45dihydro12oxazole3carboxylate
ethyl5((4((Z)(2((2hydroxyphenyl)carbonyl)hydrazinylidene)methyl)67dimethoxy13benzodioxol5yl)methyl)45dihydro12oxazole3carboxylate
InChI=1SC24H25N3O9c143324(30)171013(362717)91516(11252623(29)14756818(14)28)2022(35123420)21(323)19(15)312h58111328H491012H213H3(H2629)b2511
MFCD10039010
ZINC000015085412
ZINC000015085415

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Available files

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