(2S)-4-methylsulfanyl-2-(phenethylcarbamoylamino)butanoate

Systemtic Name: (2S)-4-methylsulfanyl-2-(phenethylcarbamoylamino)butanoate Openeye Name: (2S)-4-methylsulfanyl-2-(phenethylcarbamoylamino)butanoate CAS Name: (2S)-4-(methylthio)-2-[[oxo-(phenethylamino)methyl]amino]butanoate IUPAC Name: (2S)-4-methylsulfanyl-2-(phenethylcarbamoylamino)butanoate Traditional Name: (2S)-4-(methylthio)-2-(phenethylcarbamoylamino)butyrate Formula: C14H19N2O3S- MolecularWeight: 295.37726

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)NCCC1=CC=CC=C1

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)NCCC1=CC=CC=C1

InChI

InChI=1S/C14H20N2O3S/c1-20-10-8-12(13(17)18)16-14(19)15-9-7-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H,17,18)(H2,15,16,19)/p-1/t12-/m0/s1