[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] (2S)-3-methyl-2-(2-thienylsulfonylamino)butanoate CAS Name: (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Traditional Name: (2S)-3-methyl-2-(2-thienylsulfonylamino)butyric acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C20H25NO5S2 MolecularWeight: 423.5462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C(C(C)C)NS(=O)(=O)C2=CC=CS2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=CS2)C)C

InChI

InChI=1S/C20H25NO5S2/c1-12(2)19(21-28(24,25)18-7-6-8-27-18)20(23)26-11-17(22)16-10-14(4)13(3)9-15(16)5/h6-10,12,19,21H,11H2,1-5H3/t19-/m0/s1