3-[(3-methoxyphenyl)sulfonylamino]-4-[3-(2-methylpropyl)phenyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[(3-methoxyphenyl)sulfonylamino]-4-[3-(2-methylpropyl)phenyl]thiophene-2-carboxylic acid Openeye Name: 4-(3-isobutylphenyl)-3-[(3-methoxyphenyl)sulfonylamino]thiophene-2-carboxylic acid CAS Name: 3-[(3-methoxyphenyl)sulfonylamino]-4-[3-(2-methylpropyl)phenyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[(3-methoxyphenyl)sulfonylamino]-4-[3-(2-methylpropyl)phenyl]thiophene-2-carboxylic acid Traditional Name: 4-(3-isobutylphenyl)-3-[(3-methoxyphenyl)sulfonylamino]-2-thenoic acid Formula: C22H23NO5S2 MolecularWeight: 445.55172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=CC(=C1)C2=CSC(=C2NS(=O)(=O)C3=CC=CC(=C3)OC)C(=O)O

Isomeric SMILES

CC(C)CC1=CC=CC(=C1)C2=CSC(=C2NS(=O)(=O)C3=CC=CC(=C3)OC)C(=O)O

InChI

InChI=1S/C22H23NO5S2/c1-14(2)10-15-6-4-7-16(11-15)19-13-29-21(22(24)25)20(19)23-30(26,27)18-9-5-8-17(12-18)28-3/h4-9,11-14,23H,10H2,1-3H3,(H,24,25)