2-[[3-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[3-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[3-(acetylthio)-1,4-dioxo-4-(4-phenylphenyl)butyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[3-(acetylthio)-4-keto-4-(4-phenylphenyl)butanoyl]amino]-4-(methylthio)butyric acid Formula: C23H25NO5S2 MolecularWeight: 459.5783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)NC(CCSC)C(=O)O)C(=O)C1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)SC(CC(=O)NC(CCSC)C(=O)O)C(=O)C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C23H25NO5S2/c1-15(25)31-20(14-21(26)24-19(23(28)29)12-13-30-2)22(27)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-20H,12-14H2,1-2H3,(H,24,26)(H,28,29)