2-acetamido-3-(3-chlorophenyl)sulfanyl-propanoic acid

Systemtic Name: 2-acetamido-3-(3-chlorophenyl)sulfanyl-propanoic acid Openeye Name: 2-acetamido-3-(3-chlorophenyl)sulfanyl-propanoic acid CAS Name: 2-acetamido-3-[(3-chlorophenyl)thio]propanoic acid IUPAC Name: 2-acetamido-3-(3-chlorophenyl)sulfanylpropanoic acid Traditional Name: 2-acetamido-3-[(3-chlorophenyl)thio]propionic acid Formula: C11H12ClNO3S MolecularWeight: 273.73588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC(=CC=C1)Cl)C(=O)O

Isomeric SMILES

CC(=O)NC(CSC1=CC(=CC=C1)Cl)C(=O)O

InChI

InChI=1S/C11H12ClNO3S/c1-7(14)13-10(11(15)16)6-17-9-4-2-3-8(12)5-9/h2-5,10H,6H2,1H3,(H,13,14)(H,15,16)