methyl (2R)-2-acetamido-3-[(2-chlorophenyl)methylsulfanyl]propanoate

Systemtic Name: methyl (2R)-2-acetamido-3-[(2-chlorophenyl)methylsulfanyl]propanoate Openeye Name: methyl (2R)-2-acetamido-3-[(2-chlorophenyl)methylsulfanyl]propanoate CAS Name: (2R)-2-acetamido-3-[(2-chlorophenyl)methylthio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-acetamido-3-[(2-chlorophenyl)methylsulfanyl]propanoate Traditional Name: (2R)-2-acetamido-3-[(2-chlorobenzyl)thio]propionic acid methyl ester Formula: C13H16ClNO3S MolecularWeight: 301.78904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSCC1=CC=CC=C1Cl)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CSCC1=CC=CC=C1Cl)C(=O)OC

InChI

InChI=1S/C13H16ClNO3S/c1-9(16)15-12(13(17)18-2)8-19-7-10-5-3-4-6-11(10)14/h3-6,12H,7-8H2,1-2H3,(H,15,16)/t12-/m0/s1