(4-methylsulfanylphenyl)methyl (2S)-2-(phenylcarbamoylamino)propanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl (2S)-2-(phenylcarbamoylamino)propanoate Openeye Name: (4-methylsulfanylphenyl)methyl (2S)-2-(phenylcarbamoylamino)propanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]propanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl (2S)-2-(phenylcarbamoylamino)propanoate Traditional Name: (2S)-2-(phenylcarbamoylamino)propionic acid [4-(methylthio)benzyl] ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)SC)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=C(C=C1)SC)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O3S/c1-13(19-18(22)20-15-6-4-3-5-7-15)17(21)23-12-14-8-10-16(24-2)11-9-14/h3-11,13H,12H2,1-2H3,(H2,19,20,22)/t13-/m0/s1