Vitas-M small molecule compound
methyl N-({2-[2-(4-methoxyphenyl)ethyl]-1-oxo-1,2-dihydroisoquinolin-4-yl}carbonyl)glycinate
Catalog ID
STL473064
SMILES COC(=O)CNC(=O)c1cn(CCc2ccc(cc2)OC)c(=O)c2c1cccc2
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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 C22H22N2O5 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5/c1-28-16-9-7-15(8-10-16)11-12-24-14-19(21(26)23-13-20(25)29-2)17-5-3-4-6-18(17)22(24)27/h3-10,14H,11-13H2,1-2H3,(H,23,26)InChIKey
WJXFENSCQWTWPU-UHFFFAOYSA-NSynonyms
1435991-13-11435991131
COC1=CC=C(C=C1)CCN2C=C(C3=CC=CC=C3C2=O)C(=O)NCC(=O)OC
InChI=1SC22H22N2O5c128169715(81016)1112241419(21(26)231320(25)292)17534618(17)22(24)27h31014H1113H212H3(H2326)
methyl2((2(2(4methoxyphenyl)ethyl)1oxoisoquinoline4carbonyl)amino)acetate
methyl2(2(4methoxyphenethyl)1oxo12dihydroisoquinoline4carboxamido)acetate
methylN((2(2(4methoxyphenyl)ethyl)1oxo12dihydroisoquinolin4yl)carbonyl)glycinate
MFCD23136467
ZINC000085877222
ZINC85877222
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