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

Systemtic Name: 2-[2,3-bis(phenylcarbonylsulfanyl)propanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[2,3-bis(benzoylsulfanyl)propanoylamino]-3-phenyl-propanoic acid CAS Name: 2-[[2,3-bis(benzoylthio)-1-oxopropyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[2,3-bis(benzoylsulfanyl)propanoylamino]-3-phenylpropanoic acid Traditional Name: 2-[2,3-bis(benzoylthio)propanoylamino]-3-phenyl-propionic acid Formula: C26H23NO5S2 MolecularWeight: 493.59452

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C26H23NO5S2/c28-23(27-21(24(29)30)16-18-10-4-1-5-11-18)22(34-26(32)20-14-8-3-9-15-20)17-33-25(31)19-12-6-2-7-13-19/h1-15,21-22H,16-17H2,(H,27,28)(H,29,30)