Vitas-M small molecule compound
methyl 2-{[N-(3-bromophenyl)-N-(methylsulfonyl)glycyl]amino}benzoate
Catalog ID
STL139692
SMILES COC(=O)c1ccccc1NC(=O)CN(S(=O)(=O)C)c1cccc(c1)Br
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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 C17H17BrN2O5S MW 441.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrN2O5S/c1-25-17(22)14-8-3-4-9-15(14)19-16(21)11-20(26(2,23)24)13-7-5-6-12(18)10-13/h3-10H,11H2,1-2H3,(H,19,21)InChIKey
WYCQTNDTJQMPIZ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=CC=C2)Br)S(=O)(=O)C
InChI=1SC17H17BrN2O5Sc12517(22)14834915(14)1916(21)1120(26(223)24)1375612(18)1013h310H11H212H3(H1921)
METHYL2((2(3BROMONMETHYLSULFONYLANILINO)ACETYL)AMINO)BENZOATE
methyl2((N(3bromophenyl)N(methylsulfonyl)glycyl)amino)benzoate
MFCD02576816
ZINC000000827699
ZINC00827699
ZINC827699
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