3-[5-[5-(2-methylimidazol-1-yl)thiophen-2-yl]-1-(4-sulfamoylphenyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[5-[5-(2-methylimidazol-1-yl)thiophen-2-yl]-1-(4-sulfamoylphenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[5-[5-(2-methylimidazol-1-yl)-2-thienyl]-1-(4-sulfamoylphenyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[5-[5-(2-methyl-1-imidazolyl)-2-thiophenyl]-1-(4-sulfamoylphenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[5-[5-(2-methylimidazol-1-yl)thiophen-2-yl]-1-(4-sulfamoylphenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[5-[5-(2-methylimidazol-1-yl)-2-thienyl]-1-(4-sulfamoylphenyl)pyrrol-2-yl]propionic acid Formula: C21H20N4O4S2 MolecularWeight: 456.5379

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(S2)C3=CC=C(N3C4=CC=C(C=C4)S(=O)(=O)N)CCC(=O)O

Isomeric SMILES

CC1=NC=CN1C2=CC=C(S2)C3=CC=C(N3C4=CC=C(C=C4)S(=O)(=O)N)CCC(=O)O

InChI

InChI=1S/C21H20N4O4S2/c1-14-23-12-13-24(14)20-10-9-19(30-20)18-8-4-16(5-11-21(26)27)25(18)15-2-6-17(7-3-15)31(22,28)29/h2-4,6-10,12-13H,5,11H2,1H3,(H,26,27)(H2,22,28,29)