Vitas-M small molecule compound

methyl 2-({2,2,2-trichloro-1-[(2,2-dimethylpropanoyl)amino]ethyl}amino)benzoate

Catalog ID
STK808783
SMILES COC(=O)c1ccccc1NC(C(Cl)(Cl)Cl)NC(=O)C(C)(C)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 C15H19Cl3N2O3 MW 381.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19Cl3N2O3/c1-14(2,3)13(22)20-12(15(16,17)18)19-10-8-6-5-7-9(10)11(21)23-4/h5-8,12,19H,1-4H3,(H,20,22)
InChIKey
RDWIXJORBBBXGM-UHFFFAOYSA-N
Synonyms

CC(C)(C)C(=O)NC(C(Cl)(Cl)Cl)NC1=CC=CC=C1C(=O)OC
InChI=1SC15H19Cl3N2O3c114(23)13(22)2012(15(1617)18)191086579(10)11(21)234h581219H14H3(H2022)
methyl2((222trichloro1((22dimethylpropanoyl)amino)ethyl)amino)benzoate
METHYL2((222TRICHLORO1(22DIMETHYLPROPANOYLAMINO)ETHYL)AMINO)BENZOATE
MFCD00648790
ZINC000001446739
ZINC000001446740

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Available files

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