Vitas-M small molecule compound

methyl 3-acetyl-4-oxo-N-(phenylsulfonyl)-2-(trifluoromethyl)norvalinate

Catalog ID
STK679622
SMILES COC(=O)C(C(F)(F)F)(C(C(=O)C)C(=O)C)NS(=O)(=O)c1ccccc1

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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 C15H16F3NO6S MW 395.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16F3NO6S/c1-9(20)12(10(2)21)14(13(22)25-3,15(16,17)18)19-26(23,24)11-7-5-4-6-8-11/h4-8,12,19H,1-3H3
InChIKey
LPWOAHDAPGPQMG-UHFFFAOYSA-N
Synonyms

CC(=O)C(C(=O)C)C(C(=O)OC)(C(F)(F)F)NS(=O)(=O)C1=CC=CC=C1
InChI=1SC15H16F3NO6Sc19(20)12(10(2)21)14(13(22)25315(1617)18)1926(2324)117546811h481219H13H3
METHYL3ACETYL2(BENZENESULFONAMIDO)4OXO2(TRIFLUOROMETHYL)PENTANOATE
METHYL3ACETYL4OXO2((PHENYLSULFONYL)AMINO)2(TRIFLUOROMETHYL)PENTANOATE
methyl3acetyl4oxoN(phenylsulfonyl)2(trifluoromethyl)norvalinate
MFCD03764033
PENTANOICACID3ACETYL2BENZENESULFONYLAMINO4OXO2TRIFLUOROMETHYLMETHYLESTER
ZINC000100123964
ZINC000100123967

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Available files

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