methyl 3-oxidanyl-2-(4-phenylsulfanylbutanoylamino)propanoate

Systemtic Name: methyl 3-oxidanyl-2-(4-phenylsulfanylbutanoylamino)propanoate Openeye Name: methyl 3-hydroxy-2-(4-phenylsulfanylbutanoylamino)propanoate CAS Name: 3-hydroxy-2-[[1-oxo-4-(phenylthio)butyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-(4-phenylsulfanylbutanoylamino)propanoate Traditional Name: 3-hydroxy-2-[4-(phenylthio)butanoylamino]propionic acid methyl ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CCCSC1=CC=CC=C1

Isomeric SMILES

COC(=O)C(CO)NC(=O)CCCSC1=CC=CC=C1

InChI

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