Vitas-M small molecule compound
(1Z)-1-(6-tert-butyl-1,1-dimethyl-2,3-dihydro-1H-inden-4-yl)-N-hydroxy-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanimine
Catalog ID
STL538001
SMILES O/N=C(\c1cc(cc2c1CCC2(C)C)C(C)(C)C)/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 C29H38N2O4 MW 478.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N2O4/c1-28(2,3)18-13-20(19-8-10-29(4,5)21(19)14-18)22(30-32)15-23-25-17(9-11-31(23)6)12-24-26(27(25)33-7)35-16-34-24/h12-14,23,32H,8-11,15-16H2,1-7H3/b30-22-InChIKey
COTWGGIERJHNGH-SWKFRHMKSA-NSynonyms
(~(N)~(Z))~(N)(1(6~(tert)butyl11dimethyl23dihydroinden4yl)2(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin5yl)ethylidene)hydroxylamine
(1Z)1(6tertbutyl11dimethyl23dihydro1Hinden4yl)Nhydroxy2(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)ethanimine
(Z)1(6(tertbutyl)11dimethyl23dihydro1Hinden4yl)2(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)ethanoneoxime
9622388
InChI=1SC29H38N2O4c128(23)181320(1981029(45)21(19)1418)22(3032)15232517(91131(23)6)122426(27(25)337)35163424h12142332H8111516H217H3b3022
MFCD03006235
ON=C(c1cc(cc2c1CCC2(C)C)C(C)(C)C)CC1N(C)CCc2c1c(OC)c1c(c2)OCO1
ZINC000020411362
ZINC000020411365
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