2-[[3-[(4-cyclobutyl-1,3-thiazol-2-yl)methoxy]phenyl]methyl-[4-[(4-fluorophenyl)sulfonylamino]butyl]sulfamoyl]benzoic acid

Systemtic Name: 2-[[3-[(4-cyclobutyl-1,3-thiazol-2-yl)methoxy]phenyl]methyl-[4-[(4-fluorophenyl)sulfonylamino]butyl]sulfamoyl]benzoic acid Openeye Name: 2-[[3-[(4-cyclobutylthiazol-2-yl)methoxy]phenyl]methyl-[4-[(4-fluorophenyl)sulfonylamino]butyl]sulfamoyl]benzoic acid CAS Name: 2-[[3-[(4-cyclobutyl-2-thiazolyl)methoxy]phenyl]methyl-[4-[(4-fluorophenyl)sulfonylamino]butyl]sulfamoyl]benzoic acid IUPAC Name: 2-[[3-[(4-cyclobutyl-1,3-thiazol-2-yl)methoxy]phenyl]methyl-[4-[(4-fluorophenyl)sulfonylamino]butyl]sulfamoyl]benzoic acid Traditional Name: 2-[[3-[(4-cyclobutylthiazol-2-yl)methoxy]benzyl]-[4-[(4-fluorophenyl)sulfonylamino]butyl]sulfamoyl]benzoic acid Formula: C32H34FN3O7S3 MolecularWeight: 687.821663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C2=CSC(=N2)COC3=CC=CC(=C3)CN(CCCCNS(=O)(=O)C4=CC=C(C=C4)F)S(=O)(=O)C5=CC=CC=C5C(=O)O

Isomeric SMILES

C1CC(C1)C2=CSC(=N2)COC3=CC=CC(=C3)CN(CCCCNS(=O)(=O)C4=CC=C(C=C4)F)S(=O)(=O)C5=CC=CC=C5C(=O)O

InChI

InChI=1S/C32H34FN3O7S3/c33-25-13-15-27(16-14-25)45(39,40)34-17-3-4-18-36(46(41,42)30-12-2-1-11-28(30)32(37)38)20-23-7-5-10-26(19-23)43-21-31-35-29(22-44-31)24-8-6-9-24/h1-2,5,7,10-16,19,22,24,34H,3-4,6,8-9,17-18,20-21H2,(H,37,38)