2-[2-ethanoylsulfanylethyl(phenethylcarbamoyl)amino]ethanoic acid

Systemtic Name: 2-[2-ethanoylsulfanylethyl(phenethylcarbamoyl)amino]ethanoic acid Openeye Name: 2-[2-acetylsulfanylethyl(phenethylcarbamoyl)amino]acetic acid CAS Name: 2-[2-(acetylthio)ethyl-[oxo-(phenethylamino)methyl]amino]acetic acid IUPAC Name: 2-[2-acetylsulfanylethyl(phenethylcarbamoyl)amino]acetic acid Traditional Name: 2-[2-(acetylthio)ethyl-(phenethylcarbamoyl)amino]acetic acid Formula: C15H20N2O4S MolecularWeight: 324.3953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCN(CC(=O)O)C(=O)NCCC1=CC=CC=C1

Isomeric SMILES

CC(=O)SCCN(CC(=O)O)C(=O)NCCC1=CC=CC=C1

InChI

InChI=1S/C15H20N2O4S/c1-12(18)22-10-9-17(11-14(19)20)15(21)16-8-7-13-5-3-2-4-6-13/h2-6H,7-11H2,1H3,(H,16,21)(H,19,20)