Vitas-M small molecule compound
N-{4-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]phenyl}-1,3-benzodioxole-5-carboxamide
Catalog ID
STL550909
SMILES COc1c2c(CCN(C2Cc2ccc(cc2)NC(=O)c2ccc3c(c2)OCO3)C)cc2c1OCO2
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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 C27H26N2O6 MW 474.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O6/c1-29-10-9-17-12-23-25(35-15-34-23)26(31-2)24(17)20(29)11-16-3-6-19(7-4-16)28-27(30)18-5-8-21-22(13-18)33-14-32-21/h3-8,12-13,20H,9-11,14-15H2,1-2H3,(H,28,30)InChIKey
WTORHKOFCATUPW-UHFFFAOYSA-NSynonyms
~(N)(4((4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin5yl)methyl)phenyl)13benzodioxole5carboxamide
129895084
InChI=1SC27H26N2O6c12910917122325(35153423)26(312)24(17)20(29)11163619(7416)2827(30)18582122(1318)33143221h38121320H9111415H212H3(H2830)
MFCD31757844
N(4((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)methyl)phenyl)13benzodioxole5carboxamide
N(4((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)methyl)phenyl)benzo(d)(13)dioxole5carboxamide
ZINC000524730128
ZINC000524730129
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