2-[(E)-[(4E)-4-[(2-Chlorophenyl)Methylidene]-5-Oxo-2-Sulfanylideneimidazolidin-1-Yl]Iminomethyl]-3-Phenylquinazolin-4-One
[CAS# 169471-14-1]

Identification

• Name: 2-[(E)-[(4E)-4-[(2-Chlorophenyl)Methylidene]-5-Oxo-2-Sulfanylideneimidazolidin-1-Yl]Iminomethyl]-3-Phenylquinazolin-4-One
• Synonyms: 2-[(E)-[(4E)-4-[(2-Chlorophenyl)Methylene]-5-Oxo-2-Thioxo-Imidazolidin-1-Yl]Iminomethyl]-3-Phenyl-Quinazolin-4-One; 2-[(E)-[(4E)-4-[(2-Chlorophenyl)Methylene]-5-Oxo-2-Thioxo-1-Imidazolidinyl]Iminomethyl]-3-Phenyl-4-Quinazolinone; 2-[(E)-[(4E)-4-(2-Chlorobenzylidene)-5-Keto-2-Thioxo-Imidazolidin-1-Yl]Iminomethyl]-3-Phenyl-Quinazolin-4-One
• Molecular Formula: C₂₅H₁₆ClN₅O₂S
• Molecular Weight: 485.95
• CAS Registry Number: 169471-14-1
• SMILES: C1=CC=CC2=C1C(=O)N(C(=N2)/C=N/N3C(=O)\C(NC3=S)=C/C4=C(Cl)C=CC=C4)C5=CC=CC=C5
• InChI: 1S/C25H16ClN5O2S/c26-19-12-6-4-8-16(19)14-21-24(33)31(25(34)29-21)27-15-22-28-20-13-7-5-11-18(20)23(32)30(22)17-9-2-1-3-10-17/h1-15H,(H,29,34)/b21-14+,27-15+
• InChIKey: IJMYGNMSVGBYOY-HRFNUEPQSA-N

Properties

• Density: 1.428g/cm³ (Cal.)
• Boiling point: 657.87°C at 760 mmHg (Cal.)
• Flash point: 351.667°C (Cal.)