4-methylsulfanyl-2-[(1-methylsulfonylpyrrolidin-2-yl)carbonylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[(1-methylsulfonylpyrrolidin-2-yl)carbonylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[(1-methylsulfonylpyrrolidine-2-carbonyl)amino]butanoic acid CAS Name: 2-[[(1-methylsulfonyl-2-pyrrolidinyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 4-methylsulfanyl-2-[(1-methylsulfonylpyrrolidine-2-carbonyl)amino]butanoic acid Traditional Name: 2-[(1-mesylprolyl)amino]-4-(methylthio)butyric acid Formula: C11H20N2O5S2 MolecularWeight: 324.4169

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1CCCN1S(=O)(=O)C

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1CCCN1S(=O)(=O)C

InChI

InChI=1S/C11H20N2O5S2/c1-19-7-5-8(11(15)16)12-10(14)9-4-3-6-13(9)20(2,17)18/h8-9H,3-7H2,1-2H3,(H,12,14)(H,15,16)