2-(dibenzofuran-2-ylsulfonylamino)-6-(4-thiophen-2-ylbutanoylamino)hexanoic acid

Systemtic Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-(4-thiophen-2-ylbutanoylamino)hexanoic acid Openeye Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[4-(2-thienyl)butanoylamino]hexanoic acid CAS Name: 2-(2-dibenzofuranylsulfonylamino)-6-[(1-oxo-4-thiophen-2-ylbutyl)amino]hexanoic acid IUPAC Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-(4-thiophen-2-ylbutanoylamino)hexanoic acid Traditional Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[4-(2-thienyl)butanoylamino]hexanoic acid Formula: C26H28N2O6S2 MolecularWeight: 528.64032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)S(=O)(=O)NC(CCCCNC(=O)CCCC4=CC=CS4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)S(=O)(=O)NC(CCCCNC(=O)CCCC4=CC=CS4)C(=O)O

InChI

InChI=1S/C26H28N2O6S2/c29-25(12-5-7-18-8-6-16-35-18)27-15-4-3-10-22(26(30)31)28-36(32,33)19-13-14-24-21(17-19)20-9-1-2-11-23(20)34-24/h1-2,6,8-9,11,13-14,16-17,22,28H,3-5,7,10,12,15H2,(H,27,29)(H,30,31)