3-[[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Amino]-1-[(Phenyl-Pyridin-2-Ylmethylidene)Amino]Thiourea
[CAS# 142047-99-2]

Identification

• Name: 3-[[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Amino]-1-[(Phenyl-Pyridin-2-Ylmethylidene)Amino]Thiourea
• Synonyms: 3-[[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Amino]-1-[[Phenyl-(2-Pyridyl)Methylene]Amino]Thiourea; 3-[[(E)-(6-Keto-1-Cyclohexa-2,4-Dienylidene)Methyl]Amino]-1-[[Phenyl-(2-Pyridyl)Methylene]Amino]Thiourea; 3-[[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Amino]-1-[(Phenyl-Pyridin-2-Yl-Methylidene)Amino]Thiourea
• Molecular Formula: C₂₀H₁₇N₅OS
• Molecular Weight: 375.45
• CAS Registry Number: 142047-99-2
• SMILES: C3=C(\C(=N/NC(=S)NN/C=C1/C(=O)C=CC=C1)C2=CC=CC=N2)C=CC=C3
• InChI: 1S/C20H17N5OS/c26-18-12-5-4-10-16(18)14-22-24-20(27)25-23-19(15-8-2-1-3-9-15)17-11-6-7-13-21-17/h1-14,22H,(H2,24,25,27)/b16-14+,23-19+
• InChIKey: OKRSJWSBSPONJA-WKTFSJQUSA-N

Properties

• Density: 1.258g/cm³ (Cal.)
• Boiling point: 557.024°C at 760 mmHg (Cal.)
• Flash point: 290.678°C (Cal.)