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

Systemtic Name: (5Z)-5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-2-phenacylsulfanyl-3-phenyl-imidazol-4-one hydrobromide Openeye Name: (5Z)-5-[(4-hydroxy-3-methoxy-phenyl)methylene]-2-phenacylsulfanyl-3-phenyl-imidazol-4-one hydrobromide CAS Name: (5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-(phenacylthio)-3-phenyl-4-imidazolone hydrobromide IUPAC Name: (5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-phenacylsulfanyl-3-phenylimidazol-4-one hydrobromide Traditional Name: (5Z)-2-(phenacylthio)-3-phenyl-5-vanillylidene-2-imidazolin-4-one hydrobromide Formula: C25H21BrN2O4S MolecularWeight: 525.41424

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/b20-14-;