2-(4-chlorophenyl)sulfanyl-5-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]benzoic acid

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-5-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]benzoic acid Openeye Name: 2-(4-chlorophenyl)sulfanyl-5-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzoic acid CAS Name: 2-[(4-chlorophenyl)thio]-5-[[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonylamino]benzoic acid IUPAC Name: 2-(4-chlorophenyl)sulfanyl-5-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzoic acid Traditional Name: 2-[(4-chlorophenyl)thio]-5-[[4-(2-ketopyrrolidino)phenyl]sulfonylamino]benzoic acid Formula: C23H19ClN2O5S2 MolecularWeight: 502.99036

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)SC4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)SC4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C23H19ClN2O5S2/c24-15-3-8-18(9-4-15)32-21-12-5-16(14-20(21)23(28)29)25-33(30,31)19-10-6-17(7-11-19)26-13-1-2-22(26)27/h3-12,14,25H,1-2,13H2,(H,28,29)