Vitas-M small molecule compound

dimethyl 2-{[N-(4-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzene-1,4-dicarboxylate

Catalog ID
STL113443
SMILES COc1ccc(cc1)N(S(=O)(=O)C)CC(=O)Nc1cc(ccc1C(=O)OC)C(=O)OC

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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 C20H22N2O8S MW 450.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O8S/c1-28-15-8-6-14(7-9-15)22(31(4,26)27)12-18(23)21-17-11-13(19(24)29-2)5-10-16(17)20(25)30-3/h5-11H,12H2,1-4H3,(H,21,23)
InChIKey
UBADXYCONZJZDO-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)N(CC(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)S(=O)(=O)C
DIMETHYL2((2(4METHOXYNMETHYLSULFONYLANILINO)ACETYL)AMINO)BENZENE14DICARBOXYLATE
dimethyl2((N(4methoxyphenyl)N(methylsulfonyl)glycyl)amino)benzene14dicarboxylate
InChI=1SC20H22N2O8Sc128158614(7915)22(31(426)27)1218(23)21171113(19(24)292)51016(17)20(25)303h511H12H214H3(H2123)
MFCD04358516
ZINC000001118045
ZINC01118045
ZINC1118045

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Available files

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