2-[5-[[[4-(2-methylpropyl)phenyl]-thiophen-2-yl-methyl]sulfamoyl]thiophen-2-yl]ethanoic acid

Systemtic Name: 2-[5-[[[4-(2-methylpropyl)phenyl]-thiophen-2-yl-methyl]sulfamoyl]thiophen-2-yl]ethanoic acid Openeye Name: 2-[5-[[(4-isobutylphenyl)-(2-thienyl)methyl]sulfamoyl]-2-thienyl]acetic acid CAS Name: 2-[5-[[[4-(2-methylpropyl)phenyl]-thiophen-2-ylmethyl]sulfamoyl]-2-thiophenyl]acetic acid IUPAC Name: 2-[5-[[[4-(2-methylpropyl)phenyl]-thiophen-2-ylmethyl]sulfamoyl]thiophen-2-yl]acetic acid Traditional Name: 2-[5-[[(4-isobutylphenyl)-(2-thienyl)methyl]sulfamoyl]-2-thienyl]acetic acid Formula: C21H23NO4S3 MolecularWeight: 449.60662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C2=CC=CS2)NS(=O)(=O)C3=CC=C(S3)CC(=O)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C2=CC=CS2)NS(=O)(=O)C3=CC=C(S3)CC(=O)O

InChI

InChI=1S/C21H23NO4S3/c1-14(2)12-15-5-7-16(8-6-15)21(18-4-3-11-27-18)22-29(25,26)20-10-9-17(28-20)13-19(23)24/h3-11,14,21-22H,12-13H2,1-2H3,(H,23,24)