1-[3-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-1,4-dioxo-4-(4-phenylphenyl)butyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)-4-keto-4-(4-phenylphenyl)butanoyl]proline Formula: C23H23NO5S MolecularWeight: 425.49742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)N1CCCC1C(=O)O)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)SC(CC(=O)N1CCCC1C(=O)O)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H23NO5S/c1-15(25)30-20(14-21(26)24-13-5-8-19(24)23(28)29)22(27)18-11-9-17(10-12-18)16-6-3-2-4-7-16/h2-4,6-7,9-12,19-20H,5,8,13-14H2,1H3,(H,28,29)