Vitas-M small molecule compound
(3E)-4-(4-ethoxyphenyl)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)but-3-en-2-one
Catalog ID
STL562788
SMILES CCOc1ccc(cc1)/C=C/C(=O)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 C24H27NO5 MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO5/c1-4-28-19-9-6-16(7-10-19)5-8-18(26)14-20-22-17(11-12-25(20)2)13-21-23(24(22)27-3)30-15-29-21/h5-10,13,20H,4,11-12,14-15H2,1-3H3/b8-5+InChIKey
QIOZSWGHSBEEKO-VMPITWQZSA-NSynonyms
858750-72-8(3E)4(4ethoxyphenyl)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)but3en2one
(E)4(4ethoxyphenyl)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)but3en2one
(E)4(4ethoxyphenyl)1(4methoxy6methyl78dihydro5H(13)dioxolo(45g)isoquinolin5yl)but3en2one
5904541
858750728
CCOc1ccc(cc1)C=CC(=O)CC1N(C)CCc2c1c(OC)c1c(c2)OCO1
InChI=1SC24H27NO5c1428199616(71019)5818(26)14202217(111225(20)2)132123(24(22)273)30152921h5101320H411121415H213H3b85+
MFCD03005663
ZINC000020410835
ZINC000020410837
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