(5S)-5-(1H-Imidazol-5-Ylmethyl)-3-Phenyl-2-Thioxo-4-Imidazolidinone
[CAS# 29635-98-1]

Identification

• Name: (5S)-5-(1H-Imidazol-5-Ylmethyl)-3-Phenyl-2-Thioxo-4-Imidazolidinone
• Synonyms: 4-IMIDAZOLIDINONE, 5-(1H-IMIDAZOL-4-YLMETHYL)-3-PHENYL-2-THIOXO-, (S)-; ZINC00403545
• Molecular Formula: C₁₃H₁₂N₄OS
• Molecular Weight: 272.33
• CAS Registry Number: 29635-98-1
• SMILES: O=C1N(C(=S)N[C@H]1Cc2cncn2)c3ccccc3
• InChI: 1S/C13H12N4OS/c18-12-11(6-9-7-14-8-15-9)16-13(19)17(12)10-4-2-1-3-5-10/h1-5,7-8,11H,6H2,(H,14,15)(H,16,19)/t11-/m0/s1
• InChIKey: BANMZNRKVSFJBK-NSHDSACASA-N

Properties

• Density: 1.458g/cm³ (Cal.)
• Boiling point: 499.724°C at 760 mmHg (Cal.)
• Flash point: 256.024°C (Cal.)
• Refractive index: 1.728 (Cal.)