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

Systemtic Name: 1-[6-[ethanoyl(methyl)amino]-2-(sulfanylmethyl)hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[6-[acetyl(methyl)amino]-2-(sulfanylmethyl)hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[6-[acetyl(methyl)amino]-2-(mercaptomethyl)-1-oxohexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[6-[acetyl(methyl)amino]-2-(sulfanylmethyl)hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[6-[acetyl(methyl)amino]-2-(mercaptomethyl)hexanoyl]proline Formula: C15H26N2O4S MolecularWeight: 330.44294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2O4S/c1-11(18)16(2)8-4-3-6-12(10-22)14(19)17-9-5-7-13(17)15(20)21/h12-13,22H,3-10H2,1-2H3,(H,20,21)