5-(2-Oxohexahydro-1H-Thieno[3,4-d]Imidazol-4-Yl)-N-[2-(2-Pyridinyldisulfanyl)Ethyl]Pentanamide
[CAS# 112247-65-1]

Identification

• Name: 5-(2-Oxohexahydro-1H-Thieno[3,4-d]Imidazol-4-Yl)-N-[2-(2-Pyridinyldisulfanyl)Ethyl]Pentanamide
• Synonyms: Biotin-[2-(2-pyridyldithio)ethylamide]
• Molecular Formula: C₁₇H₂₄N₄O₂S₃
• Molecular Weight: 412.59
• CAS Registry Number: 112247-65-1
• SMILES: O=C1NC2C(SCC2N1)CCCCC(=O)NCCSSc3ncccc3
• InChI: 1S/C17H24N4O2S3/c22-14(18-9-10-25-26-15-7-3-4-8-19-15)6-2-1-5-13-16-12(11-24-13)20-17(23)21-16/h3-4,7-8,12-13,16H,1-2,5-6,9-11H2,(H,18,22)(H2,20,21,23)
• InChIKey: MAJOROISBURONW-UHFFFAOYSA-N

Properties

• Density: 1.366g/cm³ (Cal.)
• Boiling point: 739.203°C at 760 mmHg (Cal.)
• Flash point: 400.856°C (Cal.)
• Refractive index: 1.657 (Cal.)