(2S)-2-[2,3-bis(phenylcarbonylsulfanyl)propanoylamino]-2-phenyl-ethanoic acid

Systemtic Name: (2S)-2-[2,3-bis(phenylcarbonylsulfanyl)propanoylamino]-2-phenyl-ethanoic acid Openeye Name: (2S)-2-[2,3-bis(benzoylsulfanyl)propanoylamino]-2-phenyl-acetic acid CAS Name: (2S)-2-[[2,3-bis(benzoylthio)-1-oxopropyl]amino]-2-phenylacetic acid IUPAC Name: (2S)-2-[2,3-bis(benzoylsulfanyl)propanoylamino]-2-phenylacetic acid Traditional Name: (2S)-2-[2,3-bis(benzoylthio)propanoylamino]-2-phenyl-acetic acid Formula: C25H21NO5S2 MolecularWeight: 479.56794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)NC(=O)C(CSC(=O)C2=CC=CC=C2)SC(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C25H21NO5S2/c27-22(26-21(23(28)29)17-10-4-1-5-11-17)20(33-25(31)19-14-8-3-9-15-19)16-32-24(30)18-12-6-2-7-13-18/h1-15,20-21H,16H2,(H,26,27)(H,28,29)/t20?,21-/m0/s1