Vitas-M small molecule compound
2-[2-(4-chlorophenyl)ethyl]-3-[(4-methoxybenzyl)amino]-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Catalog ID
STK098810
SMILES COc1ccc(cc1)CNC1N(CCc2ccc(cc2)Cl)C(=O)C2=C1CCCC2
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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 C24H27ClN2O2 MW 410.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN2O2/c1-29-20-12-8-18(9-13-20)16-26-23-21-4-2-3-5-22(21)24(28)27(23)15-14-17-6-10-19(25)11-7-17/h6-13,23,26H,2-5,14-16H2,1H3InChIKey
QNCJZFGZSWVXKG-UHFFFAOYSA-NSynonyms
2(2(4chlorophenyl)ethyl)3((4methoxybenzyl)amino)234567hexahydro1Hisoindol1one
2(2(4chlorophenyl)ethyl)3((4methoxyphenyl)methylamino)4567tetrahydro3Hisoindol1one
COC1=CC=C(C=C1)CNC2C3=C(CCCC3)C(=O)N2CCC4=CC=C(C=C4)Cl
COc1ccc(cc1)CNC1N(CCc2ccc(cc2)Cl)C(=O)C2=C1CCCC2
InChI=1SC24H27ClN2O2c1292012818(91320)16262321423522(21)24(28)27(23)15141761019(25)11717h6132326H251416H21H3
MFCD11851138
STK098810
ZINC000057381668
ZINC000057381670
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