(2S)-3-(4-phenylphenyl)-2-[[(2S)-2-phenyl-2-sulfanyl-ethanoyl]amino]propanoic acid

Systemtic Name: (2S)-3-(4-phenylphenyl)-2-[[(2S)-2-phenyl-2-sulfanyl-ethanoyl]amino]propanoic acid Openeye Name: (2S)-3-(4-phenylphenyl)-2-[[(2S)-2-phenyl-2-sulfanyl-acetyl]amino]propanoic acid CAS Name: (2S)-2-[[(2S)-2-mercapto-1-oxo-2-phenylethyl]amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: (2S)-3-(4-phenylphenyl)-2-[[(2S)-2-phenyl-2-sulfanylacetyl]amino]propanoic acid Traditional Name: (2S)-2-[[(2S)-2-mercapto-2-phenyl-acetyl]amino]-3-(4-phenylphenyl)propionic acid Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C(C3=CC=CC=C3)S

Isomeric SMILES

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

InChI

InChI=1S/C23H21NO3S/c25-22(21(28)19-9-5-2-6-10-19)24-20(23(26)27)15-16-11-13-18(14-12-16)17-7-3-1-4-8-17/h1-14,20-21,28H,15H2,(H,24,25)(H,26,27)/t20-,21-/m0/s1