Vitas-M small molecule compound
(2Z)-2-(2,6-dichlorobenzylidene)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK575946
SMILES OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1c(Cl)cccc1Cl)/C2=O
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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 C22H22Cl2N2O4 MW 449.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N2O4/c23-17-2-1-3-18(24)15(17)12-20-21(29)14-4-5-19(28)16(22(14)30-20)13-26-8-6-25(7-9-26)10-11-27/h1-5,12,27-28H,6-11,13H2/b20-12-InChIKey
UTHWVSOVXWJUNS-NDENLUEZSA-NSynonyms
899388-61-5(2Z)2((26DICHLOROPHENYL)METHYLIDENE)6HYDROXY7((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)1BENZOFURAN3ONE
(2Z)2(26dichlorobenzylidene)7((4(2hydroxyethyl)piperazin1ium1yl)methyl)3oxo23dihydro1benzofuran6olate
2((26DICHLOROPHENYL)METHYLENE)6HYDROXY7((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)BENZO(B)FURAN3ONE
C1CN(CCN1CCO)CC2=C(C=CC3=C2OC(=CC4=C(C=CC=C4Cl)Cl)C3=O)O
OCCN1CC(NH+)(CC1)Cc1c((O))ccc2c1OC(=Cc1c(Cl)cccc1Cl)C2=O
Registry IDs
MFCD06607508ZINC000020533227
ZINC20533227
Check stock
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