2-oxidanyl-5-[[(4-propylphenyl)-thiophen-2-yl-methyl]sulfamoyl]benzoic acid

Systemtic Name: 2-oxidanyl-5-[[(4-propylphenyl)-thiophen-2-yl-methyl]sulfamoyl]benzoic acid Openeye Name: 2-hydroxy-5-[[(4-propylphenyl)-(2-thienyl)methyl]sulfamoyl]benzoic acid CAS Name: 2-hydroxy-5-[[(4-propylphenyl)-thiophen-2-ylmethyl]sulfamoyl]benzoic acid IUPAC Name: 2-hydroxy-5-[[(4-propylphenyl)-thiophen-2-ylmethyl]sulfamoyl]benzoic acid Traditional Name: 2-hydroxy-5-[[(4-propylphenyl)-(2-thienyl)methyl]sulfamoyl]benzoic acid Formula: C21H21NO5S2 MolecularWeight: 431.52514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO5S2/c1-2-4-14-6-8-15(9-7-14)20(19-5-3-12-28-19)22-29(26,27)16-10-11-18(23)17(13-16)21(24)25/h3,5-13,20,22-23H,2,4H2,1H3,(H,24,25)