Vitas-M small molecule compound
4-{(Z)-[2-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)hydrazinylidene]methyl}-2-methoxyphenyl 1,3-benzodioxole-5-carboxylate
Catalog ID
STK150730
SMILES COc1cc(/C=N\NC(=O)C2COc3c(O2)cccc3)ccc1OC(=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 C25H20N2O8 MW 476.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O8/c1-30-21-10-15(12-26-27-24(28)23-13-31-17-4-2-3-5-19(17)34-23)6-8-20(21)35-25(29)16-7-9-18-22(11-16)33-14-32-18/h2-12,23H,13-14H2,1H3,(H,27,28)/b26-12-InChIKey
WHQMNOPLQAQRNA-ZRGSRPPYSA-NSynonyms
(4((Z)(23DIHYDRO14BENZODIOXINE3CARBONYLHYDRAZINYLIDENE)METHYL)2METHOXYPHENYL)13BENZODIOXOLE5CARBOXYLATE
4((Z)(2(23DIHYDRO14BENZODIOXIN2YLCARBONYL)HYDRAZINYLIDENE)METHYL)2METHOXYPHENYL13BENZODIOXOLE5CARBOXYLATE
COC1=C(C=CC(=C1)C=NNC(=O)C2COC3=CC=CC=C3O2)OC(=O)C4=CC5=C(C=C4)OCO5
COc1cc(C=NNC(=O)C2COc3c(O2)cccc3)ccc1OC(=O)c1ccc2c(c1)OCO2
InChI=1SC25H20N2O8c130211015(12262724(28)23133117423519(17)3423)6820(21)3525(29)16791822(1116)33143218h21223H1314H21H3(H2728)b2612
MFCD32649515
ZINC000032654829
ZINC000032654830
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