S-phenyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanethioate

Systemtic Name: S-phenyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanethioate Openeye Name: S-phenyl (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanethioate CAS Name: (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanethioic acid S-phenyl ester IUPAC Name: S-phenyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanethioate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanethioic acid S-phenyl ester Formula: C23H21NO3S MolecularWeight: 391.48274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)SC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)SC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21NO3S/c25-22(28-20-14-8-3-9-15-20)21(16-18-10-4-1-5-11-18)24-23(26)27-17-19-12-6-2-7-13-19/h1-15,21H,16-17H2,(H,24,26)/t21-/m0/s1