Vitas-M small molecule compound
2-(4-bromo-2-methylphenyl)-5-phenylhexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK258527
SMILES Brc1ccc(c(c1)C)N1C(=O)C2C(C1=O)CCC(C2)c1ccccc1
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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 C21H20BrNO2 MW 398.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrNO2/c1-13-11-16(22)8-10-19(13)23-20(24)17-9-7-15(12-18(17)21(23)25)14-5-3-2-4-6-14/h2-6,8,10-11,15,17-18H,7,9,12H2,1H3InChIKey
FIRSCXKURKFPSN-UHFFFAOYSA-NSynonyms
2(4bromo2methylphenyl)5phenyl3a45677ahexahydroisoindole13dione
2(4bromo2methylphenyl)5phenylhexahydro1Hisoindole13(2H)dione
CC1=C(C=CC(=C1)Br)N2C(=O)C3CCC(CC3C2=O)C4=CC=CC=C4
InChI=1SC21H20BrNO2c1131116(22)81019(13)2320(24)179715(1218(17)21(23)25)145324614h2681011151718H7912H21H3
MFCD03900805
ZINC000018244044
ZINC000239302488
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