Vitas-M small molecule compound
methyl ({2-[2-(4-chlorophenyl)ethyl]-3-oxo-2,3,4,5,6,7-hexahydro-1H-isoindol-1-yl}amino)(3-methoxyphenyl)acetate
Catalog ID
STK052904
SMILES COc1cccc(c1)C(C(=O)OC)NC1N(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 C26H29ClN2O4 MW 468.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29ClN2O4/c1-32-20-7-5-6-18(16-20)23(26(31)33-2)28-24-21-8-3-4-9-22(21)25(30)29(24)15-14-17-10-12-19(27)13-11-17/h5-7,10-13,16,23-24,28H,3-4,8-9,14-15H2,1-2H3InChIKey
QKZARSOBQATHQV-UHFFFAOYSA-NSynonyms
COC1=CC=CC(=C1)C(C(=O)OC)NC2C3=C(CCCC3)C(=O)N2CCC4=CC=C(C=C4)Cl
COc1cccc(c1)C(C(=O)OC)NC1N(CCc2ccc(cc2)Cl)C(=O)C2=C1CCCC2
InChI=1SC26H29ClN2O4c1322075618(1620)23(26(31)332)282421834922(21)25(30)29(24)151417101219(27)131117h57101316232428H34891415H212H3
methyl((2(2(4chlorophenyl)ethyl)3oxo234567hexahydro1Hisoindol1yl)amino)(3methoxyphenyl)acetate
methyl2((2(2(4chlorophenyl)ethyl)3oxo4567tetrahydro1Hisoindol1yl)amino)2(3methoxyphenyl)acetate
MFCD11851026
STK052904
ZINC000020130614
ZINC000020130623
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