4-methoxy-3-[[(4-propylphenyl)-thiophen-2-yl-methyl]sulfamoyl]benzoic acid

Systemtic Name: 4-methoxy-3-[[(4-propylphenyl)-thiophen-2-yl-methyl]sulfamoyl]benzoic acid Openeye Name: 4-methoxy-3-[[(4-propylphenyl)-(2-thienyl)methyl]sulfamoyl]benzoic acid CAS Name: 4-methoxy-3-[[(4-propylphenyl)-thiophen-2-ylmethyl]sulfamoyl]benzoic acid IUPAC Name: 4-methoxy-3-[[(4-propylphenyl)-thiophen-2-ylmethyl]sulfamoyl]benzoic acid Traditional Name: 4-methoxy-3-[[(4-propylphenyl)-(2-thienyl)methyl]sulfamoyl]benzoic acid Formula: C22H23NO5S2 MolecularWeight: 445.55172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)O)OC

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)O)OC

InChI

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