2-azanyl-3-(3-methoxybutanoyl)-1-(3-methyl-2-sulfanyl-pentanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 2-azanyl-3-(3-methoxybutanoyl)-1-(3-methyl-2-sulfanyl-pentanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 2-amino-3-(3-methoxybutanoyl)-1-(3-methyl-2-sulfanyl-pentanoyl)pyrrolidine-2-carboxylic acid CAS Name: 2-amino-1-(2-mercapto-3-methyl-1-oxopentyl)-3-(3-methoxy-1-oxobutyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 2-amino-3-(3-methoxybutanoyl)-1-(3-methyl-2-sulfanylpentanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 2-amino-1-(2-mercapto-3-methyl-pentanoyl)-3-(3-methoxybutanoyl)proline Formula: C16H28N2O5S MolecularWeight: 360.46892

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCC(C1(C(=O)O)N)C(=O)CC(C)OC)S

Isomeric SMILES

CCC(C)C(C(=O)N1CCC(C1(C(=O)O)N)C(=O)CC(C)OC)S

InChI

InChI=1S/C16H28N2O5S/c1-5-9(2)13(24)14(20)18-7-6-11(16(18,17)15(21)22)12(19)8-10(3)23-4/h9-11,13,24H,5-8,17H2,1-4H3,(H,21,22)