(1-oxidanylidene-1-phenyl-butan-2-yl) 4-oxidanylidene-4-[(4-phenylsulfanylphenyl)amino]butanoate

Systemtic Name: (1-oxidanylidene-1-phenyl-butan-2-yl) 4-oxidanylidene-4-[(4-phenylsulfanylphenyl)amino]butanoate Openeye Name: 1-benzoylpropyl 4-oxo-4-(4-phenylsulfanylanilino)butanoate CAS Name: 4-oxo-4-[4-(phenylthio)anilino]butanoic acid (1-oxo-1-phenylbutan-2-yl) ester IUPAC Name: (1-oxo-1-phenylbutan-2-yl) 4-oxo-4-(4-phenylsulfanylanilino)butanoate Traditional Name: 4-keto-4-[4-(phenylthio)anilino]butyric acid 1-benzoylpropyl ester Formula: C26H25NO4S MolecularWeight: 447.546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)OC(=O)CCC(=O)NC2=CC=C(C=C2)SC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)OC(=O)CCC(=O)NC2=CC=C(C=C2)SC3=CC=CC=C3

InChI

InChI=1S/C26H25NO4S/c1-2-23(26(30)19-9-5-3-6-10-19)31-25(29)18-17-24(28)27-20-13-15-22(16-14-20)32-21-11-7-4-8-12-21/h3-16,23H,2,17-18H2,1H3,(H,27,28)