Vitas-M small molecule compound

4,7-dimethyl-2-oxo-2H-chromen-5-yl N-[(4-methylphenyl)sulfonyl]-beta-alaninate

Catalog ID
STL516650
SMILES O=C(Oc1cc(C)cc2c1c(C)cc(=O)o2)CCNS(=O)(=O)c1ccc(cc1)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 C21H21NO6S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO6S/c1-13-4-6-16(7-5-13)29(25,26)22-9-8-19(23)27-17-10-14(2)11-18-21(17)15(3)12-20(24)28-18/h4-7,10-12,22H,8-9H2,1-3H3
InChIKey
QXZLZNSYLBMJAG-UHFFFAOYSA-N
Synonyms
858755-20-1
(47DIMETHYL2OXOCHROMEN5YL)3((4METHYLPHENYL)SULFONYLAMINO)PROPANOATE
1749725
47DIMETHYL2OXO2HCHROMEN5YL3(4METHYLPHENYLSULFONAMIDO)PROPANOATE
47dimethyl2oxo2Hchromen5ylN((4methylphenyl)sulfonyl)betaalaninate
858755201
InChI=1SC21H21NO6Sc1134616(7513)29(2526)229819(23)27171014(2)111821(17)15(3)1220(24)2818h47101222H89H213H3
MFCD03852306
ZINC000002092866
ZINC2092866

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Available files

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