5-[1-[[2-(1-oxidanyl-1-oxidanylidene-4-phenyl-butan-2-yl)sulfanyl-3-phenyl-propanoyl]amino]ethyl]-1,3-oxazole-4-carboxylic acid

Systemtic Name: 5-[1-[[2-(1-oxidanyl-1-oxidanylidene-4-phenyl-butan-2-yl)sulfanyl-3-phenyl-propanoyl]amino]ethyl]-1,3-oxazole-4-carboxylic acid Openeye Name: 5-[1-[[2-(1-carboxy-3-phenyl-propyl)sulfanyl-3-phenyl-propanoyl]amino]ethyl]oxazole-4-carboxylic acid CAS Name: 5-[1-[[2-[(1-hydroxy-1-oxo-4-phenylbutan-2-yl)thio]-1-oxo-3-phenylpropyl]amino]ethyl]-4-oxazolecarboxylic acid IUPAC Name: 5-[1-[[2-(1-hydroxy-1-oxo-4-phenylbutan-2-yl)sulfanyl-3-phenylpropanoyl]amino]ethyl]-1,3-oxazole-4-carboxylic acid Traditional Name: 5-[1-[[2-[(1-carboxy-3-phenyl-propyl)thio]-3-phenyl-propanoyl]amino]ethyl]oxazole-4-carboxylic acid Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(N=CO1)C(=O)O)NC(=O)C(CC2=CC=CC=C2)SC(CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C1=C(N=CO1)C(=O)O)NC(=O)C(CC2=CC=CC=C2)SC(CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H26N2O6S/c1-16(22-21(25(31)32)26-15-33-22)27-23(28)20(14-18-10-6-3-7-11-18)34-19(24(29)30)13-12-17-8-4-2-5-9-17/h2-11,15-16,19-20H,12-14H2,1H3,(H,27,28)(H,29,30)(H,31,32)