2-(dibenzofuran-2-ylsulfonylamino)-6-[ethanoyl(phenylsulfanyl)amino]hexanoic acid

Systemtic Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[ethanoyl(phenylsulfanyl)amino]hexanoic acid Openeye Name: 6-[acetyl(phenylsulfanyl)amino]-2-(dibenzofuran-2-ylsulfonylamino)hexanoic acid CAS Name: 6-[acetyl-(phenylthio)amino]-2-(2-dibenzofuranylsulfonylamino)hexanoic acid IUPAC Name: 6-[acetyl(phenylsulfanyl)amino]-2-(dibenzofuran-2-ylsulfonylamino)hexanoic acid Traditional Name: 6-[acetyl-(phenylthio)amino]-2-(dibenzofuran-2-ylsulfonylamino)hexanoic acid Formula: C26H26N2O6S2 MolecularWeight: 526.62444

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCCCC(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OC3=CC=CC=C32)SC4=CC=CC=C4

Isomeric SMILES

CC(=O)N(CCCCC(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OC3=CC=CC=C32)SC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O6S2/c1-18(29)28(35-19-9-3-2-4-10-19)16-8-7-12-23(26(30)31)27-36(32,33)20-14-15-25-22(17-20)21-11-5-6-13-24(21)34-25/h2-6,9-11,13-15,17,23,27H,7-8,12,16H2,1H3,(H,30,31)