Vitas-M small molecule compound

3-(5,6-dibromo-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-N-(2-methylphenyl)benzamide

Catalog ID
STK269044
SMILES BrC1C(Br)C2CC1C1C2C(=O)N(C1=O)c1cccc(c1)C(=O)Nc1ccccc1C

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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 C23H20Br2N2O3 MW 532.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20Br2N2O3/c1-11-5-2-3-8-16(11)26-21(28)12-6-4-7-13(9-12)27-22(29)17-14-10-15(18(17)23(27)30)20(25)19(14)24/h2-9,14-15,17-20H,10H2,1H3,(H,26,28)
InChIKey
PKSKJABNRUWCNU-UHFFFAOYSA-N
Synonyms

3(56dibromo13dioxooctahydro2H47methanoisoindol2yl)N(2methylphenyl)benzamide
CC1=CC=CC=C1NC(=O)C2=CC(=CC=C2)N3C(=O)C4C5CC(C4C3=O)C(C5Br)Br
InChI=1SC23H20Br2N2O3c111523816(11)2621(28)1264713(912)2722(29)17141015(18(17)23(27)30)20(25)19(14)24h2914151720H10H21H3(H2628)
MFCD01884766
ZINC000102658688
ZINC000239174175

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Available files

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