1-(1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidin-2-yl)carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidin-2-yl)carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[1-(2-naphthylsulfonyl)-4-sulfanyl-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-mercapto-1-(2-naphthalenylsulfonyl)-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(1-naphthalen-2-ylsulfonyl-4-sulfanylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-mercapto-1-(2-naphthylsulfonyl)prolyl]proline Formula: C20H22N2O5S2 MolecularWeight: 434.52908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC(CN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C2CC(CN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S)C(=O)O

InChI

InChI=1S/C20H22N2O5S2/c23-19(21-9-3-6-17(21)20(24)25)18-11-15(28)12-22(18)29(26,27)16-8-7-13-4-1-2-5-14(13)10-16/h1-2,4-5,7-8,10,15,17-18,28H,3,6,9,11-12H2,(H,24,25)