1-[6-[ethanoyl(methyl)amino]-2-(ethanoylsulfanylmethyl)hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[6-[ethanoyl(methyl)amino]-2-(ethanoylsulfanylmethyl)hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[6-[acetyl(methyl)amino]-2-(acetylsulfanylmethyl)hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[6-[acetyl(methyl)amino]-2-[(acetylthio)methyl]-1-oxohexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[6-[acetyl(methyl)amino]-2-(acetylsulfanylmethyl)hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[6-[acetyl(methyl)amino]-2-[(acetylthio)methyl]hexanoyl]proline Formula: C17H28N2O5S MolecularWeight: 372.47962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)CCCCC(CSC(=O)C)C(=O)N1CCCC1C(=O)O

Isomeric SMILES

CC(=O)N(C)CCCCC(CSC(=O)C)C(=O)N1CCCC1C(=O)O

InChI

InChI=1S/C17H28N2O5S/c1-12(20)18(3)9-5-4-7-14(11-25-13(2)21)16(22)19-10-6-8-15(19)17(23)24/h14-15H,4-11H2,1-3H3,(H,23,24)