2-[[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]amino]ethanoic acid

Systemtic Name: 2-[[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]amino]ethanoic acid Openeye Name: 2-[[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]amino]acetic acid CAS Name: 2-[[2-oxo-2-[2-(phenylthio)ethylamino]ethyl]amino]acetic acid IUPAC Name: 2-[[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]amino]acetic acid Traditional Name: 2-[[2-keto-2-[2-(phenylthio)ethylamino]ethyl]amino]acetic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)CNCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)CNCC(=O)O

InChI

InChI=1S/C12H16N2O3S/c15-11(8-13-9-12(16)17)14-6-7-18-10-4-2-1-3-5-10/h1-5,13H,6-9H2,(H,14,15)(H,16,17)