5-[[1-(4-butan-2-ylphenyl)-2-methyl-propyl]sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[1-(4-butan-2-ylphenyl)-2-methyl-propyl]sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[2-methyl-1-(4-sec-butylphenyl)propyl]sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[1-(4-butan-2-ylphenyl)-2-methylpropyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[1-(4-butan-2-ylphenyl)-2-methylpropyl]sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[2-methyl-1-(4-sec-butylphenyl)propyl]sulfamoyl]-3-thenoic acid Formula: C19H25NO4S2 MolecularWeight: 395.5361

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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(=CS2)C(=O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C(C)C)NS(=O)(=O)C2=CC(=CS2)C(=O)O

InChI

InChI=1S/C19H25NO4S2/c1-5-13(4)14-6-8-15(9-7-14)18(12(2)3)20-26(23,24)17-10-16(11-25-17)19(21)22/h6-13,18,20H,5H2,1-4H3,(H,21,22)