Vitas-M small molecule compound
methyl N-{[1-oxo-2-(3,4,5-trimethoxyphenyl)-1,2-dihydroisoquinolin-4-yl]carbonyl}-beta-alaninate
Catalog ID
STL314136
SMILES COC(=O)CCNC(=O)c1cn(c2cc(OC)c(c(c2)OC)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 C23H24N2O7 MW 440.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O7/c1-29-18-11-14(12-19(30-2)21(18)32-4)25-13-17(22(27)24-10-9-20(26)31-3)15-7-5-6-8-16(15)23(25)28/h5-8,11-13H,9-10H2,1-4H3,(H,24,27)InChIKey
WLYFSTMEONBIDJ-UHFFFAOYSA-NSynonyms
1401585-48-51401585485
COC1=CC(=CC(=C1OC)OC)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCC(=O)OC
InChI=1SC23H24N2O7c129181114(1219(302)21(18)324)251317(22(27)2410920(26)313)15756816(15)23(25)28h581113H910H214H3(H2427)
methyl3((1oxo2(345trimethoxyphenyl)isoquinoline4carbonyl)amino)propanoate
methyl3(1oxo2(345trimethoxyphenyl)12dihydroisoquinoline4carboxamido)propanoate
methylN((1oxo2(345trimethoxyphenyl)12dihydroisoquinolin4yl)carbonyl)betaalaninate
MFCD22584036
ZINC000079485556
ZINC79485556
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