(2R)-2-acetamido-3-[(2-chlorophenyl)methylsulfanyl]propanoic acid

Systemtic Name: (2R)-2-acetamido-3-[(2-chlorophenyl)methylsulfanyl]propanoic acid Openeye Name: (2R)-2-acetamido-3-[(2-chlorophenyl)methylsulfanyl]propanoic acid CAS Name: (2R)-2-acetamido-3-[(2-chlorophenyl)methylthio]propanoic acid IUPAC Name: (2R)-2-acetamido-3-[(2-chlorophenyl)methylsulfanyl]propanoic acid Traditional Name: (2R)-2-acetamido-3-[(2-chlorobenzyl)thio]propionic acid Formula: C12H14ClNO3S MolecularWeight: 287.76246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClNO3S/c1-8(15)14-11(12(16)17)7-18-6-9-4-2-3-5-10(9)13/h2-5,11H,6-7H2,1H3,(H,14,15)(H,16,17)/t11-/m0/s1