3-(2-aminophenyl)sulfanyl-2-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(2-aminophenyl)sulfanyl-2-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 3-(2-aminophenyl)sulfanyl-2-(benzyloxycarbonylamino)-2-phenyl-propanoic acid CAS Name: 3-[(2-aminophenyl)thio]-2-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(2-aminophenyl)sulfanyl-2-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 3-[(2-aminophenyl)thio]-2-(benzyloxycarbonylamino)-2-phenyl-propionic acid Formula: C23H22N2O4S MolecularWeight: 422.49678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CSC2=CC=CC=C2N)(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CSC2=CC=CC=C2N)(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H22N2O4S/c24-19-13-7-8-14-20(19)30-16-23(21(26)27,18-11-5-2-6-12-18)25-22(28)29-15-17-9-3-1-4-10-17/h1-14H,15-16,24H2,(H,25,28)(H,26,27)