5-methyl-2-[[4-[(5-oxidanylidenepyrrolidin-2-yl)methylsulfamoylmethyl]-2-phenyl-phenyl]carbonylamino]hexanoic acid

Systemtic Name: 5-methyl-2-[[4-[(5-oxidanylidenepyrrolidin-2-yl)methylsulfamoylmethyl]-2-phenyl-phenyl]carbonylamino]hexanoic acid Openeye Name: 5-methyl-2-[[4-[(5-oxopyrrolidin-2-yl)methylsulfamoylmethyl]-2-phenyl-benzoyl]amino]hexanoic acid CAS Name: 5-methyl-2-[[oxo-[4-[(5-oxo-2-pyrrolidinyl)methylsulfamoylmethyl]-2-phenylphenyl]methyl]amino]hexanoic acid IUPAC Name: 5-methyl-2-[[4-[(5-oxopyrrolidin-2-yl)methylsulfamoylmethyl]-2-phenylbenzoyl]amino]hexanoic acid Traditional Name: 2-[[4-[(5-ketopyrrolidin-2-yl)methylsulfamoylmethyl]-2-phenyl-benzoyl]amino]-5-methyl-hexanoic acid Formula: C26H33N3O6S MolecularWeight: 515.62172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(=O)O)NC(=O)C1=C(C=C(C=C1)CS(=O)(=O)NCC2CCC(=O)N2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCC(C(=O)O)NC(=O)C1=C(C=C(C=C1)CS(=O)(=O)NCC2CCC(=O)N2)C3=CC=CC=C3

InChI

InChI=1S/C26H33N3O6S/c1-17(2)8-12-23(26(32)33)29-25(31)21-11-9-18(14-22(21)19-6-4-3-5-7-19)16-36(34,35)27-15-20-10-13-24(30)28-20/h3-7,9,11,14,17,20,23,27H,8,10,12-13,15-16H2,1-2H3,(H,28,30)(H,29,31)(H,32,33)