3-phenyl-2-(phenylsulfanylcarbamoylamino)propanoic acid

Systemtic Name: 3-phenyl-2-(phenylsulfanylcarbamoylamino)propanoic acid Openeye Name: 3-phenyl-2-(phenylsulfanylcarbamoylamino)propanoic acid CAS Name: 2-[[oxo-[(phenylthio)amino]methyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-2-(phenylsulfanylcarbamoylamino)propanoic acid Traditional Name: 3-phenyl-2-[(phenylthio)carbamoylamino]propionic acid Formula: C16H16N2O3S MolecularWeight: 316.37484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)NSC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)NSC2=CC=CC=C2

InChI

InChI=1S/C16H16N2O3S/c19-15(20)14(11-12-7-3-1-4-8-12)17-16(21)18-22-13-9-5-2-6-10-13/h1-10,14H,11H2,(H,19,20)(H2,17,18,21)