Vitas-M small molecule compound

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

Catalog ID
STL182942
SMILES COC(=O)c1ccc(cc1)NC(=O)CN(S(=O)(=O)c1ccccc1)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 C22H19FN2O5S MW 442.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FN2O5S/c1-30-22(27)16-7-11-18(12-8-16)24-21(26)15-25(19-13-9-17(23)10-14-19)31(28,29)20-5-3-2-4-6-20/h2-14H,15H2,1H3,(H,24,26)
InChIKey
AEEVOFQKCUCFIL-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3
InChI=1SC22H19FN2O5Sc13022(27)1671118(12816)2421(26)1525(1913917(23)101419)31(2829)205324620h214H15H21H3(H2426)
METHYL4((2(N(BENZENESULFONYL)4FLUOROANILINO)ACETYL)AMINO)BENZOATE
methyl4((N(4fluorophenyl)N(phenylsulfonyl)glycyl)amino)benzoate
MFCD01012391
ZINC000001013773
ZINC01013773
ZINC1013773

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Available files

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