methyl 2-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]amino]-3-oxidanyl-butanoate

Systemtic Name: methyl 2-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]amino]-3-oxidanyl-butanoate Openeye Name: methyl 2-[[2-(acetylsulfanylmethyl)-3-phenyl-propanoyl]amino]-3-hydroxy-butanoate CAS Name: 2-[[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]amino]-3-hydroxybutanoic acid methyl ester IUPAC Name: methyl 2-[[2-(acetylsulfanylmethyl)-3-phenylpropanoyl]amino]-3-hydroxybutanoate Traditional Name: 2-[[2-[(acetylthio)methyl]-3-phenyl-propanoyl]amino]-3-hydroxy-butyric acid methyl ester Formula: C17H23NO5S MolecularWeight: 353.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)NC(=O)C(CC1=CC=CC=C1)CSC(=O)C)O

Isomeric SMILES

CC(C(C(=O)OC)NC(=O)C(CC1=CC=CC=C1)CSC(=O)C)O

InChI

InChI=1S/C17H23NO5S/c1-11(19)15(17(22)23-3)18-16(21)14(10-24-12(2)20)9-13-7-5-4-6-8-13/h4-8,11,14-15,19H,9-10H2,1-3H3,(H,18,21)