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

Systemtic Name: (2S)-4-methylsulfanyl-2-[2-(2-propan-2-ylphenoxy)ethanoylamino]butanoic acid Openeye Name: (2S)-2-[[2-(2-isopropylphenoxy)acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: (2S)-4-(methylthio)-2-[[1-oxo-2-(2-propan-2-ylphenoxy)ethyl]amino]butanoic acid IUPAC Name: (2S)-4-methylsulfanyl-2-[[2-(2-propan-2-ylphenoxy)acetyl]amino]butanoic acid Traditional Name: (2S)-2-[[2-(2-isopropylphenoxy)acetyl]amino]-4-(methylthio)butyric acid Formula: C16H23NO4S MolecularWeight: 325.42312

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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)/t13-/m0/s1