N-(1H-indol-6-yl)-2-[(4E)-4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1H-indol-6-yl)-2-[(4E)-4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[(4E)-4-[(4-hydroxy-3-methoxy-phenyl)methylene]-5-oxo-1-phenyl-imidazol-2-yl]sulfanyl-N-(1H-indol-6-yl)acetamide CAS Name: 2-[[(4E)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxo-1-phenyl-2-imidazolyl]thio]-N-(1H-indol-6-yl)acetamide IUPAC Name: 2-[(4E)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxo-1-phenylimidazol-2-yl]sulfanyl-N-(1H-indol-6-yl)acetamide Traditional Name: N-(1H-indol-6-yl)-2-[[(4E)-5-keto-1-phenyl-4-vanillylidene-2-imidazolin-2-yl]thio]acetamide Formula: C27H22N4O4S MolecularWeight: 498.55298

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)NC3=CC4=C(C=C3)C=CN4)C5=CC=CC=C5)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C(=O)N(C(=N2)SCC(=O)NC3=CC4=C(C=C3)C=CN4)C5=CC=CC=C5)O

InChI

InChI=1S/C27H22N4O4S/c1-35-24-14-17(7-10-23(24)32)13-22-26(34)31(20-5-3-2-4-6-20)27(30-22)36-16-25(33)29-19-9-8-18-11-12-28-21(18)15-19/h2-15,28,32H,16H2,1H3,(H,29,33)/b22-13+