Vitas-M small molecule compound
2-(4-fluorophenyl)-2-oxoethyl 2-(4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoate
Catalog ID
STK275695
SMILES CCCCC(N1C(=O)c2c(C1=O)c(Cl)c(c(c2Cl)Cl)Cl)C(=O)OCC(=O)c1ccc(cc1)F
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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 C22H16Cl4FNO5 MW 535.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16Cl4FNO5/c1-2-3-4-12(22(32)33-9-13(29)10-5-7-11(27)8-6-10)28-20(30)14-15(21(28)31)17(24)19(26)18(25)16(14)23/h5-8,12H,2-4,9H2,1H3InChIKey
NCHZNWIQCPVGCM-UHFFFAOYSA-NSynonyms
(2(4fluorophenyl)2oxoethyl)2(4567tetrachloro13dioxoisoindol2yl)hexanoate
2(4fluorophenyl)2oxoethyl2(4567tetrachloro13dioxo13dihydro2Hisoindol2yl)hexanoate
CCCCC(C(=O)OCC(=O)C1=CC=C(C=C1)F)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl
InChI=1SC22H16Cl4FNO5c123412(22(32)33913(29)105711(27)8610)2820(30)1415(21(28)31)17(24)19(26)18(25)16(14)23h5812H249H21H3
MFCD03103431
ZINC000102087885
ZINC000102087890
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