2-[3-[[[4-(methylsulfamoyl)phenyl]methyl-pyridin-3-ylsulfonyl-amino]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[3-[[[4-(methylsulfamoyl)phenyl]methyl-pyridin-3-ylsulfonyl-amino]methyl]phenyl]ethanoic acid Openeye Name: 2-[3-[[[4-(methylsulfamoyl)phenyl]methyl-(3-pyridylsulfonyl)amino]methyl]phenyl]acetic acid CAS Name: 2-[3-[[[4-(methylsulfamoyl)phenyl]methyl-(3-pyridinylsulfonyl)amino]methyl]phenyl]acetic acid IUPAC Name: 2-[3-[[[4-(methylsulfamoyl)phenyl]methyl-pyridin-3-ylsulfonylamino]methyl]phenyl]acetic acid Traditional Name: 2-[3-[[[4-(methylsulfamoyl)benzyl]-(3-pyridylsulfonyl)amino]methyl]phenyl]acetic acid Formula: C22H23N3O6S2 MolecularWeight: 489.56452

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)CN(CC2=CC=CC(=C2)CC(=O)O)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)CN(CC2=CC=CC(=C2)CC(=O)O)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H23N3O6S2/c1-23-32(28,29)20-9-7-17(8-10-20)15-25(33(30,31)21-6-3-11-24-14-21)16-19-5-2-4-18(12-19)13-22(26)27/h2-12,14,23H,13,15-16H2,1H3,(H,26,27)