1-[2,3-bis(phenylcarbonylsulfanyl)propanoyl]azetidine-2-carboxylic acid

Systemtic Name: 1-[2,3-bis(phenylcarbonylsulfanyl)propanoyl]azetidine-2-carboxylic acid Openeye Name: 1-[2,3-bis(benzoylsulfanyl)propanoyl]azetidine-2-carboxylic acid CAS Name: 1-[2,3-bis(benzoylthio)-1-oxopropyl]-2-azetidinecarboxylic acid IUPAC Name: 1-[2,3-bis(benzoylsulfanyl)propanoyl]azetidine-2-carboxylic acid Traditional Name: 1-[2,3-bis(benzoylthio)propanoyl]azetidine-2-carboxylic acid Formula: C21H19NO5S2 MolecularWeight: 429.50926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1C(=O)O)C(=O)C(CSC(=O)C2=CC=CC=C2)SC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(C1C(=O)O)C(=O)C(CSC(=O)C2=CC=CC=C2)SC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19NO5S2/c23-18(22-12-11-16(22)19(24)25)17(29-21(27)15-9-5-2-6-10-15)13-28-20(26)14-7-3-1-4-8-14/h1-10,16-17H,11-13H2,(H,24,25)