Vitas-M small molecule compound
5-chloro-2-{[3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl]oxy}benzaldehyde
Catalog ID
STL526632
SMILES O=Cc1cc(Cl)ccc1OCC#CC1N(C)CCc2c1c(OC)c1c(c2)OCO1
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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 C22H20ClNO5 MW 413.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO5/c1-24-8-7-14-11-19-21(29-13-28-19)22(26-2)20(14)17(24)4-3-9-27-18-6-5-16(23)10-15(18)12-25/h5-6,10-12,17H,7-9,13H2,1-2H3InChIKey
NXCVLNOBTPIZBZ-UHFFFAOYSA-NSynonyms
370584-62-6370584626
3727344
5chloro2((3(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)prop2yn1yl)oxy)benzaldehyde
5chloro2(3(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin5yl)prop2ynoxy)benzaldehyde
5CHLORO2(3(4METHOXY6METHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN5YL)PROP2YNOXY)BENZALDEHYDE
InChI=1SC22H20ClNO5c1248714111921(29132819)22(262)20(14)17(24)43927186516(23)1015(18)1225h56101217H7913H212H3
MFCD03006192
ZINC000020112787
ZINC000020112789
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