1-[2,4-bis(fluoranyl)phenyl]sulfonyl-4-sulfanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]sulfonyl-4-sulfanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(2,4-difluorophenyl)sulfonyl-4-sulfanyl-pyrrolidine-2-carboxylic acid CAS Name: 1-(2,4-difluorophenyl)sulfonyl-4-mercapto-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2,4-difluorophenyl)sulfonyl-4-sulfanylpyrrolidine-2-carboxylic acid Traditional Name: 1-(2,4-difluorophenyl)sulfonyl-4-mercapto-proline Formula: C11H11F2NO4S2 MolecularWeight: 323.336146

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)S(=O)(=O)C2=C(C=C(C=C2)F)F)S

Isomeric SMILES

C1C(CN(C1C(=O)O)S(=O)(=O)C2=C(C=C(C=C2)F)F)S

InChI

InChI=1S/C11H11F2NO4S2/c12-6-1-2-10(8(13)3-6)20(17,18)14-5-7(19)4-9(14)11(15)16/h1-3,7,9,19H,4-5H2,(H,15,16)