methyl (4S)-5-oxidanyl-4-(2-phenylsulfanylethanoylamino)pentanoate

Systemtic Name: methyl (4S)-5-oxidanyl-4-(2-phenylsulfanylethanoylamino)pentanoate Openeye Name: methyl (4S)-5-hydroxy-4-[(2-phenylsulfanylacetyl)amino]pentanoate CAS Name: (4S)-5-hydroxy-4-[[1-oxo-2-(phenylthio)ethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (4S)-5-hydroxy-4-[(2-phenylsulfanylacetyl)amino]pentanoate Traditional Name: (4S)-5-hydroxy-4-[[2-(phenylthio)acetyl]amino]valeric acid methyl ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4S/c1-19-14(18)8-7-11(9-16)15-13(17)10-20-12-5-3-2-4-6-12/h2-6,11,16H,7-10H2,1H3,(H,15,17)/t11-/m0/s1