(4E)-4-[[3-methoxy-4-oxidanyl-5-(phenylsulfanylmethyl)phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: (4E)-4-[[3-methoxy-4-oxidanyl-5-(phenylsulfanylmethyl)phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4E)-4-[[4-hydroxy-3-methoxy-5-(phenylsulfanylmethyl)phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4E)-4-[[4-hydroxy-3-methoxy-5-[(phenylthio)methyl]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4E)-4-[[4-hydroxy-3-methoxy-5-(phenylsulfanylmethyl)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4E)-4-[4-hydroxy-3-methoxy-5-[(phenylthio)methyl]benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C24H20N2O4S MolecularWeight: 432.4916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)CSC2=CC=CC=C2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1O)CSC2=CC=CC=C2)/C=C/3\C(=O)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C24H20N2O4S/c1-30-21-14-16(12-17(22(21)27)15-31-19-10-6-3-7-11-19)13-20-23(28)25-26(24(20)29)18-8-4-2-5-9-18/h2-14,27H,15H2,1H3,(H,25,28)/b20-13+