(5E)-5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-2-phenacylsulfanyl-3-phenyl-imidazol-4-one bromide

Systemtic Name: (5E)-5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-2-phenacylsulfanyl-3-phenyl-imidazol-4-one bromide Openeye Name: (5E)-5-[(4-hydroxy-3-methoxy-phenyl)methylene]-2-phenacylsulfanyl-3-phenyl-imidazol-4-one bromide CAS Name: (5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-(phenacylthio)-3-phenyl-4-imidazolone bromide IUPAC Name: (5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-phenacylsulfanyl-3-phenylimidazol-4-one bromide Traditional Name: (5E)-2-(phenacylthio)-3-phenyl-5-vanillylidene-2-imidazolin-4-one bromide Formula: C25H20BrN2O4S- MolecularWeight: 524.4063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)C4=CC=CC=C4)O.[Br-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)C4=CC=CC=C4)O.[Br-]

InChI

InChI=1S/C25H20N2O4S.BrH/c1-31-23-15-17(12-13-21(23)28)14-20-24(30)27(19-10-6-3-7-11-19)25(26-20)32-16-22(29)18-8-4-2-5-9-18;/h2-15,28H,16H2,1H3;1H/p-1/b20-14+;