Vitas-M small molecule compound

methyl 4-oxo-4-({4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl}amino)butanoate

Catalog ID
STK017009
SMILES COC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(cc1C)C

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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 C20H24N2O5S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O5S/c1-13-11-14(2)20(15(3)12-13)22-28(25,26)17-7-5-16(6-8-17)21-18(23)9-10-19(24)27-4/h5-8,11-12,22H,9-10H2,1-4H3,(H,21,23)
InChIKey
XSJNDFFBEGURMO-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C(=C1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)OC)C
COC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(cc1C)C
InChI=1SC20H24N2O5Sc1131114(2)20(15(3)1213)2228(2526)177516(6817)2118(23)91019(24)274h58111222H910H214H3(H2123)
METHYL3(N(4(((246TRIMETHYLPHENYL)AMINO)SULFONYL)PHENYL)CARBAMOYL)PROPANOATE
METHYL4(4((MESITYLAMINO)SULFONYL)ANILINO)4OXOBUTANOATE
METHYL4OXO4((4((246TRIMETHYLPHENYL)SULFAMOYL)PHENYL)AMINO)BUTANOATE
METHYL4OXO4(4((246TRIMETHYLPHENYL)SULFAMOYL)ANILINO)BUTANOATE
MFCD02825023
STK017009
ZINC000001088037
ZINC01088037
ZINC1088037

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Available files

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