Vitas-M small molecule compound
4-{(E)-[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)hydrazinylidene]methyl}phenyl 4-tert-butylbenzoate
Catalog ID
STK745178
SMILES O=C(c1ccc2c(c1)OCCO2)N/N=C/c1ccc(cc1)OC(=O)c1ccc(cc1)C(C)(C)C
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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 C27H26N2O5 MW 458.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O5/c1-27(2,3)21-9-6-19(7-10-21)26(31)34-22-11-4-18(5-12-22)17-28-29-25(30)20-8-13-23-24(16-20)33-15-14-32-23/h4-13,16-17H,14-15H2,1-3H3,(H,29,30)/b28-17+InChIKey
VJESUVDJYIZFAO-OGLMXYFKSA-NSynonyms
(4((E)(23DIHYDRO14BENZODIOXINE6CARBONYLHYDRAZINYLIDENE)METHYL)PHENYL)4TERTBUTYLBENZOATE
(E)4((2(23dihydrobenzo(b)(14)dioxine6carbonyl)hydrazono)methyl)phenyl4(tertbutyl)benzoate
4((E)(2(23dihydro14benzodioxin6ylcarbonyl)hydrazinylidene)methyl)phenyl4tertbutylbenzoate
CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=CC4=C(C=C3)OCCO4
InChI=1SC27H26N2O5c127(23)219619(71021)26(31)342211418(51222)17282925(30)208132324(1620)3315143223h4131617H1415H213H3(H2930)b2817+
MFCD02241047
O=C(c1ccc2c(c1)OCCO2)NN=Cc1ccc(cc1)OC(=O)c1ccc(cc1)C(C)(C)C
ZINC000002298703
ZINC33352469
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