4-methyl-2-[methylsulfonyl-(4-sulfanylpyrrolidin-2-yl)methoxy]pentanoic acid

Systemtic Name: 4-methyl-2-[methylsulfonyl-(4-sulfanylpyrrolidin-2-yl)methoxy]pentanoic acid Openeye Name: 4-methyl-2-[methylsulfonyl-(4-sulfanylpyrrolidin-2-yl)methoxy]pentanoic acid CAS Name: 2-[(4-mercapto-2-pyrrolidinyl)-methylsulfonylmethoxy]-4-methylpentanoic acid IUPAC Name: 4-methyl-2-[methylsulfonyl-(4-sulfanylpyrrolidin-2-yl)methoxy]pentanoic acid Traditional Name: 2-[(4-mercaptopyrrolidin-2-yl)-mesyl-methoxy]-4-methyl-valeric acid Formula: C12H23NO5S2 MolecularWeight: 325.44472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)OC(C1CC(CN1)S)S(=O)(=O)C

Isomeric SMILES

CC(C)CC(C(=O)O)OC(C1CC(CN1)S)S(=O)(=O)C

InChI

InChI=1S/C12H23NO5S2/c1-7(2)4-10(11(14)15)18-12(20(3,16)17)9-5-8(19)6-13-9/h7-10,12-13,19H,4-6H2,1-3H3,(H,14,15)