2-oxidanyl-3-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]propanoic acid

Systemtic Name: 2-oxidanyl-3-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]propanoic acid Openeye Name: 3-[(2-benzyl-3-sulfanyl-propanoyl)amino]-2-hydroxy-propanoic acid CAS Name: 2-hydroxy-3-[[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]amino]propanoic acid IUPAC Name: 3-[(2-benzyl-3-sulfanylpropanoyl)amino]-2-hydroxypropanoic acid Traditional Name: 3-[(2-benzyl-3-mercapto-propanoyl)amino]-2-hydroxy-propionic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CS)C(=O)NCC(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CS)C(=O)NCC(C(=O)O)O

InChI

InChI=1S/C13H17NO4S/c15-11(13(17)18)7-14-12(16)10(8-19)6-9-4-2-1-3-5-9/h1-5,10-11,15,19H,6-8H2,(H,14,16)(H,17,18)