2-[2-[2-[2-(phenylmethylsulfanyl)ethylamino]ethanoylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[2-[2-(phenylmethylsulfanyl)ethylamino]ethanoylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[2-(2-benzylsulfanylethylamino)acetyl]amino]acetyl]amino]acetic acid CAS Name: 2-[[1-oxo-2-[[1-oxo-2-[2-(phenylmethylthio)ethylamino]ethyl]amino]ethyl]amino]acetic acid IUPAC Name: 2-[[2-[[2-(2-benzylsulfanylethylamino)acetyl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[2-[2-(benzylthio)ethylamino]acetyl]amino]acetyl]amino]acetic acid Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O4S/c19-13(17-9-14(20)18-10-15(21)22)8-16-6-7-23-11-12-4-2-1-3-5-12/h1-5,16H,6-11H2,(H,17,19)(H,18,20)(H,21,22)