Vitas-M small molecule compound

methyl 4-{[N-(4-fluorophenyl)-N-(methylsulfonyl)glycyl]amino}benzoate

Catalog ID
STK946913
SMILES COC(=O)c1ccc(cc1)NC(=O)CN(S(=O)(=O)C)c1ccc(cc1)F

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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 C17H17FN2O5S MW 380.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17FN2O5S/c1-25-17(22)12-3-7-14(8-4-12)19-16(21)11-20(26(2,23)24)15-9-5-13(18)6-10-15/h3-10H,11H2,1-2H3,(H,19,21)
InChIKey
JDSRBLZPAIYNHX-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C
InChI=1SC17H17FN2O5Sc12517(22)123714(8412)1916(21)1120(26(223)24)159513(18)61015h310H11H212H3(H1921)
METHYL4((2(4FLUORONMETHYLSULFONYLANILINO)ACETYL)AMINO)BENZOATE
methyl4((N(4fluorophenyl)N(methylsulfonyl)glycyl)amino)benzoate
MFCD04373568
ZINC000001117877
ZINC01117877
ZINC1117877

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Available files

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