4-methylsulfanyl-2-(4-phenoxybutanoylamino)butanoic acid

Systemtic Name: 4-methylsulfanyl-2-(4-phenoxybutanoylamino)butanoic acid Openeye Name: 4-methylsulfanyl-2-(4-phenoxybutanoylamino)butanoic acid CAS Name: 4-(methylthio)-2-[(1-oxo-4-phenoxybutyl)amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-(4-phenoxybutanoylamino)butanoic acid Traditional Name: 4-(methylthio)-2-(4-phenoxybutanoylamino)butyric acid Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)CCCOC1=CC=CC=C1

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)CCCOC1=CC=CC=C1

InChI

InChI=1S/C15H21NO4S/c1-21-11-9-13(15(18)19)16-14(17)8-5-10-20-12-6-3-2-4-7-12/h2-4,6-7,13H,5,8-11H2,1H3,(H,16,17)(H,18,19)