2-[4-methyl-2-[(5-oxidanylidenepyrrolidin-2-yl)carbonylamino]pentyl]sulfanylethanoate

Systemtic Name: 2-[4-methyl-2-[(5-oxidanylidenepyrrolidin-2-yl)carbonylamino]pentyl]sulfanylethanoate Openeye Name: 2-[4-methyl-2-[(5-oxopyrrolidine-2-carbonyl)amino]pentyl]sulfanylacetate CAS Name: 2-[[4-methyl-2-[[oxo-(5-oxo-2-pyrrolidinyl)methyl]amino]pentyl]thio]acetate IUPAC Name: 2-[4-methyl-2-[(5-oxopyrrolidine-2-carbonyl)amino]pentyl]sulfanylacetate Traditional Name: 2-[[4-methyl-2-(pyroglutamoylamino)pentyl]thio]acetate Formula: C13H21N2O4S- MolecularWeight: 301.38184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CSCC(=O)[O-])NC(=O)C1CCC(=O)N1

Isomeric SMILES

CC(C)CC(CSCC(=O)[O-])NC(=O)C1CCC(=O)N1

InChI

InChI=1S/C13H22N2O4S/c1-8(2)5-9(6-20-7-12(17)18)14-13(19)10-3-4-11(16)15-10/h8-10H,3-7H2,1-2H3,(H,14,19)(H,15,16)(H,17,18)/p-1