1-quinolin-8-ylsulfonyl-4-sulfanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-quinolin-8-ylsulfonyl-4-sulfanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(8-quinolylsulfonyl)-4-sulfanyl-pyrrolidine-2-carboxylic acid CAS Name: 4-mercapto-1-(8-quinolinylsulfonyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-quinolin-8-ylsulfonyl-4-sulfanylpyrrolidine-2-carboxylic acid Traditional Name: 4-mercapto-1-(8-quinolylsulfonyl)proline Formula: C14H14N2O4S2 MolecularWeight: 338.40196

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)S

Isomeric SMILES

C1C(CN(C1C(=O)O)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)S

InChI

InChI=1S/C14H14N2O4S2/c17-14(18)11-7-10(21)8-16(11)22(19,20)12-5-1-3-9-4-2-6-15-13(9)12/h1-6,10-11,21H,7-8H2,(H,17,18)