[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate

Systemtic Name: [2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Openeye Name: [2-(3-fluoroanilino)-2-oxo-ethyl] (2R)-3-methyl-2-(2-thienylsulfonylamino)butanoate CAS Name: (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoic acid [2-(3-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoroanilino)-2-oxoethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Traditional Name: (2R)-3-methyl-2-(2-thienylsulfonylamino)butyric acid [2-(3-fluoroanilino)-2-keto-ethyl] ester Formula: C17H19FN2O5S2 MolecularWeight: 414.471563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC1=CC(=CC=C1)F)NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)NC1=CC(=CC=C1)F)NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C17H19FN2O5S2/c1-11(2)16(20-27(23,24)15-7-4-8-26-15)17(22)25-10-14(21)19-13-6-3-5-12(18)9-13/h3-9,11,16,20H,10H2,1-2H3,(H,19,21)/t16-/m1/s1