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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C(C(C)C)NS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C(C(C)C)NS(=O)(=O)C1=CC=CC=C1

InChI

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