Vitas-M small molecule compound
(2Z)-7-[(dibutylammonio)methyl]-2-(2,6-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK628631
SMILES CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1c(Cl)cccc1Cl)/C2=O)CCCC
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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 C24H27Cl2NO3 MW 448.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27Cl2NO3/c1-3-5-12-27(13-6-4-2)15-18-21(28)11-10-16-23(29)22(30-24(16)18)14-17-19(25)8-7-9-20(17)26/h7-11,14,28H,3-6,12-13,15H2,1-2H3/b22-14-InChIKey
RWQVKVXQJZLEOR-HMAPJEAMSA-NSynonyms
929835-65-4929835654
CCCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1c(Cl)cccc1Cl)C2=O)CCCC
MFCD09798391
ZINC000020650017
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