2-[2-(3-phenylsulfanylpropanoylamino)ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-(3-phenylsulfanylpropanoylamino)ethanoylamino]ethanoic acid Openeye Name: 2-[[2-(3-phenylsulfanylpropanoylamino)acetyl]amino]acetic acid CAS Name: 2-[[1-oxo-2-[[1-oxo-3-(phenylthio)propyl]amino]ethyl]amino]acetic acid IUPAC Name: 2-[[2-(3-phenylsulfanylpropanoylamino)acetyl]amino]acetic acid Traditional Name: 2-[[2-[3-(phenylthio)propanoylamino]acetyl]amino]acetic acid Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O4S/c16-11(14-8-12(17)15-9-13(18)19)6-7-20-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,14,16)(H,15,17)(H,18,19)