2-[2-[2-[(3-oxidanylidene-3-phenyl-propanethioyl)amino]ethanoylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[2-[(3-oxidanylidene-3-phenyl-propanethioyl)amino]ethanoylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[2-[(3-oxo-3-phenyl-propanethioyl)amino]acetyl]amino]acetyl]amino]acetic acid CAS Name: 2-[[1-oxo-2-[[1-oxo-2-[(3-oxo-3-phenyl-1-sulfanylidenepropyl)amino]ethyl]amino]ethyl]amino]acetic acid IUPAC Name: 2-[[2-[[2-[(3-oxo-3-phenylpropanethioyl)amino]acetyl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[2-[(3-keto-3-phenyl-propanethioyl)amino]acetyl]amino]acetyl]amino]acetic acid Formula: C15H17N3O5S MolecularWeight: 351.37758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O5S/c19-11(10-4-2-1-3-5-10)6-14(24)18-8-13(21)16-7-12(20)17-9-15(22)23/h1-5H,6-9H2,(H,16,21)(H,17,20)(H,18,24)(H,22,23)