Vitas-M small molecule compound
methyl N-{[2-(2,5-dimethoxyphenyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]carbonyl}valinate
Catalog ID
STL424684
SMILES COc1ccc(c(c1)n1cc(C(=O)NC(C(=O)OC)C(C)C)c2c(c1=O)cccc2)OC
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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 C24H26N2O6 MW 438.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O6/c1-14(2)21(24(29)32-5)25-22(27)18-13-26(23(28)17-9-7-6-8-16(17)18)19-12-15(30-3)10-11-20(19)31-4/h6-14,21H,1-5H3,(H,25,27)InChIKey
LLWVNPOZDPPSNC-UHFFFAOYSA-NSynonyms
(S)methyl2(2(25dimethoxyphenyl)1oxo12dihydroisoquinoline4carboxamido)3methylbutanoate
CC(C)C(C(=O)OC)NC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=C(C=CC(=C3)OC)OC
COc1ccc(c(c1)n1cc(C(=O)N(C@H)(C(=O)OC)C(C)C)c2c(c1=O)cccc2)OC
InChI=1SC24H26N2O6c114(2)21(24(29)325)2522(27)181326(23(28)17976816(17)18)191215(303)101120(19)314h61421H15H3(H2527)
methyl2((2(25dimethoxyphenyl)1oxoisoquinoline4carbonyl)amino)3methylbutanoate
methylN((2(25dimethoxyphenyl)1oxo12dihydroisoquinolin4yl)carbonyl)valinate
MFCD30709518
ZINC000218159224
ZINC000252491314
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