4-methylsulfanyl-2-[2-(2-phenylphenoxy)ethanoylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[2-(2-phenylphenoxy)ethanoylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[[2-(2-phenylphenoxy)acetyl]amino]butanoic acid CAS Name: 4-(methylthio)-2-[[1-oxo-2-(2-phenylphenoxy)ethyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[[2-(2-phenylphenoxy)acetyl]amino]butanoic acid Traditional Name: 4-(methylthio)-2-[[2-(2-phenylphenoxy)acetyl]amino]butyric acid Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)COC1=CC=CC=C1C2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)COC1=CC=CC=C1C2=CC=CC=C2

InChI

InChI=1S/C19H21NO4S/c1-25-12-11-16(19(22)23)20-18(21)13-24-17-10-6-5-9-15(17)14-7-3-2-4-8-14/h2-10,16H,11-13H2,1H3,(H,20,21)(H,22,23)