2-[5-[[1-(4-butan-2-ylphenyl)-2-methyl-propyl]sulfamoyl]thiophen-2-yl]ethanoic acid

Systemtic Name: 2-[5-[[1-(4-butan-2-ylphenyl)-2-methyl-propyl]sulfamoyl]thiophen-2-yl]ethanoic acid Openeye Name: 2-[5-[[2-methyl-1-(4-sec-butylphenyl)propyl]sulfamoyl]-2-thienyl]acetic acid CAS Name: 2-[5-[[1-(4-butan-2-ylphenyl)-2-methylpropyl]sulfamoyl]-2-thiophenyl]acetic acid IUPAC Name: 2-[5-[[1-(4-butan-2-ylphenyl)-2-methylpropyl]sulfamoyl]thiophen-2-yl]acetic acid Traditional Name: 2-[5-[[2-methyl-1-(4-sec-butylphenyl)propyl]sulfamoyl]-2-thienyl]acetic acid Formula: C20H27NO4S2 MolecularWeight: 409.56268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C(C)C)NS(=O)(=O)C2=CC=C(S2)CC(=O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C(C)C)NS(=O)(=O)C2=CC=C(S2)CC(=O)O

InChI

InChI=1S/C20H27NO4S2/c1-5-14(4)15-6-8-16(9-7-15)20(13(2)3)21-27(24,25)19-11-10-17(26-19)12-18(22)23/h6-11,13-14,20-21H,5,12H2,1-4H3,(H,22,23)