3-(methylsulfanylmethyl)-5-oxidanyl-3-(phenethylcarbamoylamino)pentanoate

Systemtic Name: 3-(methylsulfanylmethyl)-5-oxidanyl-3-(phenethylcarbamoylamino)pentanoate Openeye Name: 5-hydroxy-3-(methylsulfanylmethyl)-3-(phenethylcarbamoylamino)pentanoate CAS Name: 5-hydroxy-3-[(methylthio)methyl]-3-[[oxo-(phenethylamino)methyl]amino]pentanoate IUPAC Name: 5-hydroxy-3-(methylsulfanylmethyl)-3-(phenethylcarbamoylamino)pentanoate Traditional Name: 5-hydroxy-3-[(methylthio)methyl]-3-(phenethylcarbamoylamino)valerate Formula: C16H23N2O4S- MolecularWeight: 339.42982

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(CCO)(CC(=O)[O-])NC(=O)NCCC1=CC=CC=C1

Isomeric SMILES

CSCC(CCO)(CC(=O)[O-])NC(=O)NCCC1=CC=CC=C1

InChI

InChI=1S/C16H24N2O4S/c1-23-12-16(8-10-19,11-14(20)21)18-15(22)17-9-7-13-5-3-2-4-6-13/h2-6,19H,7-12H2,1H3,(H,20,21)(H2,17,18,22)/p-1