2-[2-[(3-oxidanylidene-3-phenyl-2-sulfanyl-propanoyl)amino]ethanoylamino]propanoic acid

Systemtic Name: 2-[2-[(3-oxidanylidene-3-phenyl-2-sulfanyl-propanoyl)amino]ethanoylamino]propanoic acid Openeye Name: 2-[[2-[(3-oxo-3-phenyl-2-sulfanyl-propanoyl)amino]acetyl]amino]propanoic acid CAS Name: 2-[[2-[(2-mercapto-1,3-dioxo-3-phenylpropyl)amino]-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-[(3-oxo-3-phenyl-2-sulfanylpropanoyl)amino]acetyl]amino]propanoic acid Traditional Name: 2-[[2-[(3-keto-2-mercapto-3-phenyl-propanoyl)amino]acetyl]amino]propionic acid Formula: C14H16N2O5S MolecularWeight: 324.35224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CNC(=O)C(C(=O)C1=CC=CC=C1)S

Isomeric SMILES

CC(C(=O)O)NC(=O)CNC(=O)C(C(=O)C1=CC=CC=C1)S

InChI

InChI=1S/C14H16N2O5S/c1-8(14(20)21)16-10(17)7-15-13(19)12(22)11(18)9-5-3-2-4-6-9/h2-6,8,12,22H,7H2,1H3,(H,15,19)(H,16,17)(H,20,21)