methyl (2S)-4-methylsulfanyl-2-[2-(4-phenylphenoxy)ethanoylamino]butanoate

Systemtic Name: methyl (2S)-4-methylsulfanyl-2-[2-(4-phenylphenoxy)ethanoylamino]butanoate Openeye Name: methyl (2S)-4-methylsulfanyl-2-[[2-(4-phenylphenoxy)acetyl]amino]butanoate CAS Name: (2S)-4-(methylthio)-2-[[1-oxo-2-(4-phenylphenoxy)ethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-4-methylsulfanyl-2-[[2-(4-phenylphenoxy)acetyl]amino]butanoate Traditional Name: (2S)-4-(methylthio)-2-[[2-(4-phenylphenoxy)acetyl]amino]butyric acid methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)COC1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)COC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C20H23NO4S/c1-24-20(23)18(12-13-26-2)21-19(22)14-25-17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11,18H,12-14H2,1-2H3,(H,21,22)/t18-/m0/s1