2-[[4-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanylphenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[4-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanylphenyl]carbamoyl]benzoic acid Openeye Name: 2-[[4-(2,5-dioxo-1-phenyl-pyrrolidin-3-yl)sulfanylphenyl]carbamoyl]benzoic acid CAS Name: 2-[[4-[(2,5-dioxo-1-phenyl-3-pyrrolidinyl)thio]anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanylphenyl]carbamoyl]benzoic acid Traditional Name: 2-[[4-[(2,5-diketo-1-phenyl-pyrrolidin-3-yl)thio]phenyl]carbamoyl]benzoic acid Formula: C24H18N2O5S MolecularWeight: 446.47512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C24H18N2O5S/c27-21-14-20(23(29)26(21)16-6-2-1-3-7-16)32-17-12-10-15(11-13-17)25-22(28)18-8-4-5-9-19(18)24(30)31/h1-13,20H,14H2,(H,25,28)(H,30,31)