2-(2-azanylpropanoyl)-1-[2,2-bis(phenylcarbonylsulfanyl)ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 2-(2-azanylpropanoyl)-1-[2,2-bis(phenylcarbonylsulfanyl)ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 2-(2-aminopropanoyl)-1-[2,2-bis(benzoylsulfanyl)acetyl]pyrrolidine-2-carboxylic acid CAS Name: 2-(2-amino-1-oxopropyl)-1-[2,2-bis(benzoylthio)-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 2-(2-aminopropanoyl)-1-[2,2-bis(benzoylsulfanyl)acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 2-alanyl-1-[2,2-bis(benzoylthio)acetyl]proline Formula: C24H24N2O6S2 MolecularWeight: 500.58716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1(CCCN1C(=O)C(SC(=O)C2=CC=CC=C2)SC(=O)C3=CC=CC=C3)C(=O)O)N

Isomeric SMILES

CC(C(=O)C1(CCCN1C(=O)C(SC(=O)C2=CC=CC=C2)SC(=O)C3=CC=CC=C3)C(=O)O)N

InChI

InChI=1S/C24H24N2O6S2/c1-15(25)18(27)24(23(31)32)13-8-14-26(24)19(28)22(33-20(29)16-9-4-2-5-10-16)34-21(30)17-11-6-3-7-12-17/h2-7,9-12,15,22H,8,13-14,25H2,1H3,(H,31,32)