4-methylsulfanyl-2-[2-(propanoylamino)propanoylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[2-(propanoylamino)propanoylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[2-(propanoylamino)propanoylamino]butanoic acid CAS Name: 4-(methylthio)-2-[[1-oxo-2-(1-oxopropylamino)propyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[2-(propanoylamino)propanoylamino]butanoic acid Traditional Name: 4-(methylthio)-2-(2-propionamidopropanoylamino)butyric acid Formula: C11H20N2O4S MolecularWeight: 276.3525

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CCC(=O)NC(C)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C11H20N2O4S/c1-4-9(14)12-7(2)10(15)13-8(11(16)17)5-6-18-3/h7-8H,4-6H2,1-3H3,(H,12,14)(H,13,15)(H,16,17)