3-[(3-bromophenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(3-bromophenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(3-bromophenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[(3-bromophenyl)sulfonylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(3-bromophenyl)sulfonylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(3-bromophenyl)sulfonylamino]-5-phenyl-2-thenoic acid Formula: C17H12BrNO4S2 MolecularWeight: 438.31548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NS(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NS(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H12BrNO4S2/c18-12-7-4-8-13(9-12)25(22,23)19-14-10-15(24-16(14)17(20)21)11-5-2-1-3-6-11/h1-10,19H,(H,20,21)