Vitas-M small molecule compound
1-(ethylsulfonyl)-N-[(4-hydroxy-6-methyl-5-oxo-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]piperidine-4-carboxamide
Catalog ID
STL523864
SMILES CCS(=O)(=O)N1CCC(CC1)C(=O)NCc1c2OCOc2c(c2c1CCN(C2=O)C)O
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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 C20H27N3O7S MW 453.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O7S/c1-3-31(27,28)23-8-4-12(5-9-23)19(25)21-10-14-13-6-7-22(2)20(26)15(13)16(24)18-17(14)29-11-30-18/h12,24H,3-11H2,1-2H3,(H,21,25)InChIKey
YBMVGNMHEWMPPL-UHFFFAOYSA-NSynonyms
1(ethylsulfonyl)N((4hydroxy6methyl5oxo5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)piperidine4carboxamide
132352459
1ethylsulfonyl~(N)((4hydroxy6methyl5oxo78dihydro(13)dioxolo(45g)isoquinolin9yl)methyl)piperidine4carboxamide
InChI=1SC20H27N3O7Sc1331(2728)238412(5923)19(25)211014136722(2)20(26)15(13)16(24)1817(14)29113018h1224H311H212H3(H2125)
MFCD31753292
ZINC000823413085
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