2-(2-azanylpropanoyl)-1-(1-ethoxy-1-oxidanylidene-3-pentylsulfanyl-propan-2-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 2-(2-azanylpropanoyl)-1-(1-ethoxy-1-oxidanylidene-3-pentylsulfanyl-propan-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 2-(2-aminopropanoyl)-1-[2-ethoxy-2-oxo-1-(pentylsulfanylmethyl)ethyl]pyrrolidine-2-carboxylic acid CAS Name: 2-(2-amino-1-oxopropyl)-1-[1-ethoxy-1-oxo-3-(pentylthio)propan-2-yl]-2-pyrrolidinecarboxylic acid IUPAC Name: 2-(2-aminopropanoyl)-1-(1-ethoxy-1-oxo-3-pentylsulfanylpropan-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 2-alanyl-1-[1-[(amylthio)methyl]-2-ethoxy-2-keto-ethyl]proline Formula: C18H32N2O5S MolecularWeight: 388.52208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSCC(C(=O)OCC)N1CCCC1(C(=O)C(C)N)C(=O)O

Isomeric SMILES

CCCCCSCC(C(=O)OCC)N1CCCC1(C(=O)C(C)N)C(=O)O

InChI

InChI=1S/C18H32N2O5S/c1-4-6-7-11-26-12-14(16(22)25-5-2)20-10-8-9-18(20,17(23)24)15(21)13(3)19/h13-14H,4-12,19H2,1-3H3,(H,23,24)