3-[(4-bromophenyl)sulfonylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[(4-bromophenyl)sulfonylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[(4-bromophenyl)sulfonylamino]-3-(2-thienyl)propanoic acid CAS Name: 3-[(4-bromophenyl)sulfonylamino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[(4-bromophenyl)sulfonylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(brosylamino)-3-(2-thienyl)propionic acid Formula: C13H12BrNO4S2 MolecularWeight: 390.27268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CSC(=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

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