4-[5-[4-(tert-butylsulfamoyl)phenyl]-2-(furan-2-yl)-1-methyl-pyrrol-3-yl]benzoic acid

Systemtic Name: 4-[5-[4-(tert-butylsulfamoyl)phenyl]-2-(furan-2-yl)-1-methyl-pyrrol-3-yl]benzoic acid Openeye Name: 4-[5-[4-(tert-butylsulfamoyl)phenyl]-2-(2-furyl)-1-methyl-pyrrol-3-yl]benzoic acid CAS Name: 4-[5-[4-(tert-butylsulfamoyl)phenyl]-2-(2-furanyl)-1-methyl-3-pyrrolyl]benzoic acid IUPAC Name: 4-[5-[4-(tert-butylsulfamoyl)phenyl]-2-(furan-2-yl)-1-methylpyrrol-3-yl]benzoic acid Traditional Name: 4-[5-[4-(tert-butylsulfamoyl)phenyl]-2-(2-furyl)-1-methyl-pyrrol-3-yl]benzoic acid Formula: C26H26N2O5S MolecularWeight: 478.56004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C2=CC(=C(N2C)C3=CC=CO3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C2=CC(=C(N2C)C3=CC=CO3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C26H26N2O5S/c1-26(2,3)27-34(31,32)20-13-11-18(12-14-20)22-16-21(17-7-9-19(10-8-17)25(29)30)24(28(22)4)23-6-5-15-33-23/h5-16,27H,1-4H3,(H,29,30)