Vitas-M small molecule compound

2-methylpropyl {[2-(4-chlorophenyl)-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl]methyl}carbamate

Catalog ID
STK750405
SMILES CC(COC(=O)NCC12C=CC(O1)C1C2C(=O)N(C1=O)c1ccc(cc1)Cl)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 C20H21ClN2O5 MW 404.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O5/c1-11(2)9-27-19(26)22-10-20-8-7-14(28-20)15-16(20)18(25)23(17(15)24)13-5-3-12(21)4-6-13/h3-8,11,14-16H,9-10H2,1-2H3,(H,22,26)
InChIKey
GNHMVTNVKQLOBK-UHFFFAOYSA-N
Synonyms

2methylpropyl((2(4chlorophenyl)13dioxo1233a77ahexahydro4H47epoxyisoindol4yl)methyl)carbamate
2methylpropylN((2(4chlorophenyl)13dioxo77adihydro3aHoctahydro1H47epoxyisoindol4yl)methyl)carbamate
CC(C)COC(=O)NCC12C=CC(O1)C3C2C(=O)N(C3=O)C4=CC=C(C=C4)Cl
InChI=1SC20H21ClN2O5c111(2)92719(26)2210208714(2820)1516(20)18(25)23(17(15)24)135312(21)4613h38111416H910H212H3(H2226)
MFCD00745439
ZINC000004143620
ZINC000169305596

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Available files

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