2-[[4-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[2-[(4-chlorophenyl)thio]-1-oxopropyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[2-[(4-chlorophenyl)thio]propanoylamino]phenyl]sulfonylamino]acetic acid Formula: C17H17ClN2O5S2 MolecularWeight: 428.91028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H17ClN2O5S2/c1-11(26-14-6-2-12(18)3-7-14)17(23)20-13-4-8-15(9-5-13)27(24,25)19-10-16(21)22/h2-9,11,19H,10H2,1H3,(H,20,23)(H,21,22)