3-[5-(4-imidazol-1-ylphenyl)-1-[2-methyl-4-(methylsulfonylamino)phenyl]pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[5-(4-imidazol-1-ylphenyl)-1-[2-methyl-4-(methylsulfonylamino)phenyl]pyrrol-2-yl]propanoic acid Openeye Name: 3-[5-(4-imidazol-1-ylphenyl)-1-[4-(methanesulfonamido)-2-methyl-phenyl]pyrrol-2-yl]propanoic acid CAS Name: 3-[5-[4-(1-imidazolyl)phenyl]-1-[4-(methanesulfonamido)-2-methylphenyl]-2-pyrrolyl]propanoic acid IUPAC Name: 3-[5-(4-imidazol-1-ylphenyl)-1-[4-(methanesulfonamido)-2-methylphenyl]pyrrol-2-yl]propanoic acid Traditional Name: 3-[5-(4-imidazol-1-ylphenyl)-1-[4-(methanesulfonamido)-2-methyl-phenyl]pyrrol-2-yl]propionic acid Formula: C24H24N4O4S MolecularWeight: 464.53676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NS(=O)(=O)C)N2C(=CC=C2C3=CC=C(C=C3)N4C=CN=C4)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)NS(=O)(=O)C)N2C(=CC=C2C3=CC=C(C=C3)N4C=CN=C4)CCC(=O)O

InChI

InChI=1S/C24H24N4O4S/c1-17-15-19(26-33(2,31)32)5-10-22(17)28-21(9-12-24(29)30)8-11-23(28)18-3-6-20(7-4-18)27-14-13-25-16-27/h3-8,10-11,13-16,26H,9,12H2,1-2H3,(H,29,30)