[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-methyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-methyl-2-(phenylsulfonylamino)butanoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 2-(benzenesulfonamido)-3-methyl-butanoate CAS Name: 2-(benzenesulfonamido)-3-methylbutanoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-(benzenesulfonamido)-3-methylbutanoate Traditional Name: 2-(benzenesulfonamido)-3-methyl-butyric acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H25N3O6S MolecularWeight: 399.4619

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC(=O)NC(C)C)NS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)NC(=O)NC(C)C)NS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C17H25N3O6S/c1-11(2)15(20-27(24,25)13-8-6-5-7-9-13)16(22)26-10-14(21)19-17(23)18-12(3)4/h5-9,11-12,15,20H,10H2,1-4H3,(H2,18,19,21,23)