Vitas-M small molecule compound

2-(3,4-dimethylphenoxy)-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)propanamide

Catalog ID
STK428752
SMILES O=C(C(Oc1ccc(c(c1)C)C)C)NN1C(=O)C2C(C1=O)C1OC2CC1

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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 C19H22N2O5 MW 358.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O5/c1-9-4-5-12(8-10(9)2)25-11(3)17(22)20-21-18(23)15-13-6-7-14(26-13)16(15)19(21)24/h4-5,8,11,13-16H,6-7H2,1-3H3,(H,20,22)
InChIKey
OYSONYPLTCCTHY-UHFFFAOYSA-N
Synonyms

2(34dimethylphenoxy)N(13dioxo3a45677ahexahydrooctahydro1H47epoxyisoindol2yl)propanamide
2(34dimethylphenoxy)N(13dioxooctahydro2H47epoxyisoindol2yl)propanamide
CC1=C(C=C(C=C1)OC(C)C(=O)NN2C(=O)C3C4CCC(C3C2=O)O4)C
InChI=1SC19H22N2O5c194512(810(9)2)2511(3)17(22)202118(23)15136714(2613)16(15)19(21)24h458111316H67H213H3(H2022)
MFCD03233404
ZINC000102610080
ZINC000239173938

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.