S-phenyl (2S)-2-[[(2R)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanethioate

Systemtic Name: S-phenyl (2S)-2-[[(2R)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanethioate Openeye Name: S-phenyl (2S)-2-[[(2R)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]propanethioate CAS Name: (2S)-2-[[(2R)-1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]propanethioic acid S-phenyl ester IUPAC Name: S-phenyl (2S)-2-[[(2R)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanethioate Traditional Name: (2S)-2-[[(2R)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]propanethioic acid S-phenyl ester Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)SC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)SC1=CC=CC=C1)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H26N2O4S/c1-19(25(30)33-22-15-9-4-10-16-22)27-24(29)23(17-20-11-5-2-6-12-20)28-26(31)32-18-21-13-7-3-8-14-21/h2-16,19,23H,17-18H2,1H3,(H,27,29)(H,28,31)/t19-,23+/m0/s1