[2-(4-ethylphenyl)-2-oxidanylidene-ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate

Systemtic Name: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Openeye Name: [2-(4-ethylphenyl)-2-oxo-ethyl] (2R)-3-methyl-2-(2-thienylsulfonylamino)butanoate CAS Name: (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoic acid [2-(4-ethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylphenyl)-2-oxoethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Traditional Name: (2R)-3-methyl-2-(2-thienylsulfonylamino)butyric acid [2-(4-ethylphenyl)-2-keto-ethyl] ester Formula: C19H23NO5S2 MolecularWeight: 409.51962

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)COC(=O)C(C(C)C)NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)COC(=O)[C@@H](C(C)C)NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C19H23NO5S2/c1-4-14-7-9-15(10-8-14)16(21)12-25-19(22)18(13(2)3)20-27(23,24)17-6-5-11-26-17/h5-11,13,18,20H,4,12H2,1-3H3/t18-/m1/s1