methyl (2S)-3-oxidanyl-2-(2-phenylsulfanylethanoylamino)propanoate

Systemtic Name: methyl (2S)-3-oxidanyl-2-(2-phenylsulfanylethanoylamino)propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[(2-phenylsulfanylacetyl)amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[1-oxo-2-(phenylthio)ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[(2-phenylsulfanylacetyl)amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[[2-(phenylthio)acetyl]amino]propionic acid methyl ester Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CSC1=CC=CC=C1

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C12H15NO4S/c1-17-12(16)10(7-14)13-11(15)8-18-9-5-3-2-4-6-9/h2-6,10,14H,7-8H2,1H3,(H,13,15)/t10-/m0/s1