Vitas-M small molecule compound
methyl N-{[2-(1,3-benzodioxol-5-yl)-1-oxo-1,2-dihydroisoquinolin-4-yl]carbonyl}-L-valinate
Catalog ID
STL547424
SMILES COC(=O)[C@H](C(C)C)NC(=O)c1cn(c2ccc3c(c2)OCO3)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 C23H22N2O6 MW 422.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O6/c1-13(2)20(23(28)29-3)24-21(26)17-11-25(22(27)16-7-5-4-6-15(16)17)14-8-9-18-19(10-14)31-12-30-18/h4-11,13,20H,12H2,1-3H3,(H,24,26)/t20-/m0/s1InChIKey
PEKGBMQHAFMGST-FQEVSTJZSA-NSynonyms
1630913-58-4(S)methyl2(2(benzo(d)(13)dioxol5yl)1oxo12dihydroisoquinoline4carboxamido)3methylbutanoate
1630913584
91636680
COC(=O)(C@H)(C(C)C)NC(=O)c1cn(c2ccc3c(c2)OCO3)c(=O)c2c1cccc2
InChI=1SC23H22N2O6c113(2)20(23(28)293)2421(26)171125(22(27)16754615(16)17)14891819(1014)31123018h4111320H12H213H3(H2426)t20m0s1
methyl(2~(S))2((2(13benzodioxol5yl)1oxoisoquinoline4carbonyl)amino)3methylbutanoate
methylN((2(13benzodioxol5yl)1oxo12dihydroisoquinolin4yl)carbonyl)Lvalinate
ZINC000217628297
ZINC217628297
Check stock
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