Vitas-M small molecule compound
2,4-dibromo-6-{(Z)-[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)hydrazinylidene]methyl}phenyl 3,4,5-trimethoxybenzoate
Catalog ID
STK667664
SMILES COc1c(OC)cc(cc1OC)C(=O)Oc1c(/C=N\NC(=O)c2ccc3c(c2)OCCO3)cc(cc1Br)Br
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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 C26H22Br2N2O8 MW 650.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22Br2N2O8/c1-33-21-10-15(11-22(34-2)24(21)35-3)26(32)38-23-16(8-17(27)12-18(23)28)13-29-30-25(31)14-4-5-19-20(9-14)37-7-6-36-19/h4-5,8-13H,6-7H2,1-3H3,(H,30,31)/b29-13-InChIKey
ZDCALBLTRONZPK-DBFSUHOCSA-NSynonyms
(24DIBROMO6((Z)(23DIHYDRO14BENZODIOXINE6CARBONYLHYDRAZINYLIDENE)METHYL)PHENYL)345TRIMETHOXYBENZOATE
24dibromo6((Z)(2(23dihydro14benzodioxin6ylcarbonyl)hydrazinylidene)methyl)phenyl345trimethoxybenzoate
COC1=CC(=CC(=C1OC)OC)C(=O)OC2=C(C=C(C=C2C=NNC(=O)C3=CC4=C(C=C3)OCCO4)Br)Br
COc1c(OC)cc(cc1OC)C(=O)Oc1c(C=NNC(=O)c2ccc3c(c2)OCCO3)cc(cc1Br)Br
InChI=1SC26H22Br2N2O8c133211015(1122(342)24(21)353)26(32)382316(817(27)1218(23)28)13293025(31)14451920(914)37763619h45813H67H213H3(H3031)b2913
MFCD18169432
ZINC000097968614
ZINC150352641
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