Vitas-M small molecule compound

ethyl N-acetyl-3,5-diiodo-O-(methylsulfonyl)tyrosinate

Catalog ID
STK727136
SMILES CCOC(=O)C(Cc1cc(I)c(c(c1)I)OS(=O)(=O)C)NC(=O)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 C14H17I2NO6S MW 581.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17I2NO6S/c1-4-22-14(19)12(17-8(2)18)7-9-5-10(15)13(11(16)6-9)23-24(3,20)21/h5-6,12H,4,7H2,1-3H3,(H,17,18)
InChIKey
SXOCYBZKHQVRFI-UHFFFAOYSA-N
Synonyms

CCOC(=O)C(CC1=CC(=C(C(=C1)I)OS(=O)(=O)C)I)NC(=O)C
ethyl2acetamido3(35diiodo4((methylsulfonyl)oxy)phenyl)propanoate
ETHYL2ACETAMIDO3(35DIIODO4METHYLSULFONYLOXYPHENYL)PROPANOATE
ethylNacetyl35diiodoO(methylsulfonyl)tyrosinate
InChI=1SC14H17I2NO6Sc142214(19)12(178(2)18)79510(15)13(11(16)69)2324(320)21h5612H47H213H3(H1718)
MFCD01572943
ZINC000102648157
ZINC000102648158

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Available files

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