2-[[3-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[3-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[3-(acetylthio)-1,4-dioxo-4-(4-phenylphenyl)butyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[3-(acetylthio)-4-keto-4-(4-phenylphenyl)butanoyl]amino]-3-phenyl-propionic acid Formula: C27H25NO5S MolecularWeight: 475.5561

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)SC(CC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H25NO5S/c1-18(29)34-24(17-25(30)28-23(27(32)33)16-19-8-4-2-5-9-19)26(31)22-14-12-21(13-15-22)20-10-6-3-7-11-20/h2-15,23-24H,16-17H2,1H3,(H,28,30)(H,32,33)