4-[(4E)-4-[(4-methylsulfanylphenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]benzenesulfonic acid

Systemtic Name: 4-[(4E)-4-[(4-methylsulfanylphenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]benzenesulfonic acid Openeye Name: 4-[(4E)-4-[(4-methylsulfanylphenyl)methylene]-5-oxo-2-phenyl-imidazol-1-yl]benzenesulfonic acid CAS Name: 4-[(4E)-4-[[4-(methylthio)phenyl]methylidene]-5-oxo-2-phenyl-1-imidazolyl]benzenesulfonic acid IUPAC Name: 4-[(4E)-4-[(4-methylsulfanylphenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]benzenesulfonic acid Traditional Name: 4-[(4E)-5-keto-4-[4-(methylthio)benzylidene]-2-phenyl-2-imidazolin-1-yl]besylic acid Formula: C23H18N2O4S2 MolecularWeight: 450.53002

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C2C(=O)N(C(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/2\C(=O)N(C(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)O

InChI

InChI=1S/C23H18N2O4S2/c1-30-19-11-7-16(8-12-19)15-21-23(26)25(22(24-21)17-5-3-2-4-6-17)18-9-13-20(14-10-18)31(27,28)29/h2-15H,1H3,(H,27,28,29)/b21-15+