2-(2-ethanoylsulfanylethanoylamino)-3-phenyl-propanoic acid

Systemtic Name: 2-(2-ethanoylsulfanylethanoylamino)-3-phenyl-propanoic acid Openeye Name: 2-[(2-acetylsulfanylacetyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-(acetylthio)-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(2-acetylsulfanylacetyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-(acetylthio)acetyl]amino]-3-phenyl-propionic acid Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)NC(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(=O)SCC(=O)NC(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H15NO4S/c1-9(15)19-8-12(16)14-11(13(17)18)7-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,14,16)(H,17,18)