2-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]-3-hydroxy-butanoic acid CAS Name: 2-[[2-[(3-chlorophenyl)methylthio]-1-oxoethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]-3-hydroxybutanoic acid Traditional Name: 2-[[2-[(3-chlorobenzyl)thio]acetyl]amino]-3-hydroxy-butyric acid Formula: C13H16ClNO4S MolecularWeight: 317.78844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)CSCC1=CC(=CC=C1)Cl)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)CSCC1=CC(=CC=C1)Cl)O

InChI

InChI=1S/C13H16ClNO4S/c1-8(16)12(13(18)19)15-11(17)7-20-6-9-3-2-4-10(14)5-9/h2-5,8,12,16H,6-7H2,1H3,(H,15,17)(H,18,19)