Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-2-oxoethyl 2-(5,6-dibromo-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK268973
SMILES BrC1C(Br)C2CC1C1C2C(=O)N(C1=O)c1ccccc1C(=O)OCC(=O)c1ccc(c(c1)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 C26H23Br2NO5 MW 589.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Br2NO5/c1-12-7-8-14(9-13(12)2)19(30)11-34-26(33)15-5-3-4-6-18(15)29-24(31)20-16-10-17(21(20)25(29)32)23(28)22(16)27/h3-9,16-17,20-23H,10-11H2,1-2H3InChIKey
PCASIOHQAXUWBN-UHFFFAOYSA-NSynonyms
2(34dimethylphenyl)2oxoethyl2(56dibromo13dioxooctahydro2H47methanoisoindol2yl)benzoate
CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2N3C(=O)C4C5CC(C4C3=O)C(C5Br)Br)C
InChI=1SC26H23Br2NO5c1127814(913(12)2)19(30)113426(33)15534618(15)2924(31)20161017(21(20)25(29)32)23(28)22(16)27h3916172023H1011H212H3
MFCD01577467
ZINC000102661092
ZINC000239174002
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