Vitas-M small molecule compound

methyl 4-{[N-(methylsulfonyl)-N-(2,4,5-trichlorophenyl)glycyl]amino}benzoate

Catalog ID
STL102316
SMILES COC(=O)c1ccc(cc1)NC(=O)CN(S(=O)(=O)C)c1cc(Cl)c(cc1Cl)Cl

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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 C17H15Cl3N2O5S MW 465.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15Cl3N2O5S/c1-27-17(24)10-3-5-11(6-4-10)21-16(23)9-22(28(2,25)26)15-8-13(19)12(18)7-14(15)20/h3-8H,9H2,1-2H3,(H,21,23)
InChIKey
AGWSIYQNFWJXMW-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=O)CN(C2=CC(=C(C=C2Cl)Cl)Cl)S(=O)(=O)C
InChI=1SC17H15Cl3N2O5Sc12717(24)103511(6410)2116(23)922(28(225)26)15813(19)12(18)714(15)20h38H9H212H3(H2123)
METHYL4((2(245TRICHLORONMETHYLSULFONYLANILINO)ACETYL)AMINO)BENZOATE
methyl4((N(methylsulfonyl)N(245trichlorophenyl)glycyl)amino)benzoate
MFCD05802139
ZINC000001110658
ZINC01110658
ZINC1110658

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Available files

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