Vitas-M small molecule compound
3,3-dimethyl-2-oxobutyl 4-methyl-2-(4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)pentanoate
Catalog ID
STK257891
SMILES CC(CC(N1C(=O)c2c(C1=O)c(Cl)c(c(c2Cl)Cl)Cl)C(=O)OCC(=O)C(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 C20H21Cl4NO5 MW 497.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl4NO5/c1-8(2)6-9(19(29)30-7-10(26)20(3,4)5)25-17(27)11-12(18(25)28)14(22)16(24)15(23)13(11)21/h8-9H,6-7H2,1-5H3InChIKey
IOSJZOHHYXFNLH-UHFFFAOYSA-NSynonyms
(33dimethyl2oxobutyl)4methyl2(4567tetrachloro13dioxoisoindol2yl)pentanoate
33dimethyl2oxobutyl4methyl2(4567tetrachloro13dioxo13dihydro2Hisoindol2yl)pentanoate
CC(C)CC(C(=O)OCC(=O)C(C)(C)C)N1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl
InChI=1SC20H21Cl4NO5c18(2)69(19(29)30710(26)20(34)5)2517(27)1112(18(25)28)14(22)16(24)15(23)13(11)21h89H67H215H3
MFCD03037774
ZINC000008875091
ZINC000009425806
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Check stock on Vitas-MAvailable files
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