4-[2-[(5-bromanylthiophen-2-yl)sulfonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[(5-bromanylthiophen-2-yl)sulfonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(5-bromo-2-thienyl)sulfonylamino]ethyl]benzoic acid CAS Name: 4-[2-[(5-bromo-2-thiophenyl)sulfonylamino]ethyl]benzoic acid IUPAC Name: 4-[2-[(5-bromothiophen-2-yl)sulfonylamino]ethyl]benzoic acid Traditional Name: 4-[2-[(5-bromo-2-thienyl)sulfonylamino]ethyl]benzoic acid Formula: C13H12BrNO4S2 MolecularWeight: 390.27268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNS(=O)(=O)C2=CC=C(S2)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCNS(=O)(=O)C2=CC=C(S2)Br)C(=O)O

InChI

InChI=1S/C13H12BrNO4S2/c14-11-5-6-12(20-11)21(18,19)15-8-7-9-1-3-10(4-2-9)13(16)17/h1-6,15H,7-8H2,(H,16,17)