2-azanyl-3-(2-benzamido-2-oxidanylidene-ethyl)sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-(2-benzamido-2-oxidanylidene-ethyl)sulfanyl-propanoic acid Openeye Name: 2-amino-3-(2-benzamido-2-oxo-ethyl)sulfanyl-propanoic acid CAS Name: 2-amino-3-[(2-benzamido-2-oxoethyl)thio]propanoic acid IUPAC Name: 2-amino-3-(2-benzamido-2-oxoethyl)sulfanylpropanoic acid Traditional Name: 2-amino-3-[(2-benzamido-2-keto-ethyl)thio]propionic acid Formula: C12H14N2O4S MolecularWeight: 282.31556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=O)CSCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C12H14N2O4S/c13-9(12(17)18)6-19-7-10(15)14-11(16)8-4-2-1-3-5-8/h1-5,9H,6-7,13H2,(H,17,18)(H,14,15,16)