(2S)-4-methylsulfanyl-2-[2-(2-propan-2-ylphenoxy)ethanoylamino]butanoate

Systemtic Name: (2S)-4-methylsulfanyl-2-[2-(2-propan-2-ylphenoxy)ethanoylamino]butanoate Openeye Name: (2S)-2-[[2-(2-isopropylphenoxy)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-4-(methylthio)-2-[[1-oxo-2-(2-propan-2-ylphenoxy)ethyl]amino]butanoate IUPAC Name: (2S)-4-methylsulfanyl-2-[[2-(2-propan-2-ylphenoxy)acetyl]amino]butanoate Traditional Name: (2S)-2-[[2-(2-isopropylphenoxy)acetyl]amino]-4-(methylthio)butyrate Formula: C16H22NO4S- MolecularWeight: 324.41518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C16H23NO4S/c1-11(2)12-6-4-5-7-14(12)21-10-15(18)17-13(16(19)20)8-9-22-3/h4-7,11,13H,8-10H2,1-3H3,(H,17,18)(H,19,20)/p-1/t13-/m0/s1