5,6-Dimethyl-3-Phenyl-2-Thioxo-2,3-Dihydrothieno[2,3-d]Pyrimidin-4(1H)-One
[CAS# 59898-64-5]

Identification

• Name: 5,6-Dimethyl-3-Phenyl-2-Thioxo-2,3-Dihydrothieno[2,3-d]Pyrimidin-4(1H)-One
• Synonyms: 5,6-Dimethyl-3-Phenyl-2-Thioxo-1H-Thieno[3,2-E]Pyrimidin-4-One; Zinc00444790; Sbb010028
• Molecular Formula: C₁₄H₁₂N₂OS₂
• Molecular Weight: 288.38
• CAS Registry Number: 59898-64-5
• SMILES: C1=CC=CC=C1N3C(=S)NC2=C(C(=C(S2)C)C)C3=O
• InChI: 1S/C14H12N2OS2/c1-8-9(2)19-12-11(8)13(17)16(14(18)15-12)10-6-4-3-5-7-10/h3-7H,1-2H3,(H,15,18)
• InChIKey: BRIBZHXSWJHTQD-UHFFFAOYSA-N

Properties

• Density: 1.425g/cm³ (Cal.)
• Boiling point: 471.469°C at 760 mmHg (Cal.)
• Flash point: 238.936°C (Cal.)