Vitas-M small molecule compound

N-[2-(dimethylsulfamoyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)propanamide

Catalog ID
STL550201
SMILES COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)NCCS(=O)(=O)N(C)C

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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 C20H26N2O8S MW 454.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O8S/c1-12-9-16(24)19(26)20(30-12)14(13-5-6-15(23)17(10-13)29-4)11-18(25)21-7-8-31(27,28)22(2)3/h5-6,9-10,14,23,26H,7-8,11H2,1-4H3,(H,21,25)
InChIKey
VSENOZXWFXSJKJ-UHFFFAOYSA-N
Synonyms

~(N)(2(dimethylsulfamoyl)ethyl)3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxopyran2yl)propanamide
129894786
InChI=1SC20H26N2O8Sc112916(24)19(26)20(3012)14(135615(23)17(1013)294)1118(25)217831(2728)22(2)3h56910142326H7811H214H3(H2125)
MFCD31757453
N(2(dimethylsulfamoyl)ethyl)3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)propanamide
N(2(NNdimethylsulfamoyl)ethyl)3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)propanamide
ZINC000524729491
ZINC000524729492

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.