Oxythiamine Amyl Disulfide
[CAS# 84714-57-8]

Identification

• Name: Oxythiamine Amyl Disulfide
• Synonyms: N-[(Z)-4-Hydroxy-1-Methyl-2-Pentyldisulfanyl-But-1-Enyl]-N-[(2-Methyl-4-Oxo-3H-Pyrimidin-5-Yl)Methyl]Formamide; N-[(Z)-4-Hydroxy-1-Methyl-2-Pentyldisulfanylbut-1-Enyl]-N-[(2-Methyl-4-Oxo-3H-Pyrimidin-5-Yl)Methyl]Formamide; N-[(Z)-2-Amyldisulfanyl-4-Hydroxy-1-Methyl-But-1-Enyl]-N-[(4-Keto-2-Methyl-3H-Pyrimidin-5-Yl)Methyl]Formamide
• Molecular Formula: C₁₇H₂₇N₃O₃S₂
• Molecular Weight: 385.54
• CAS Registry Number: 84714-57-8
• SMILES: C(CCSSC(=C(N(CC1=CN=C(NC1=O)C)C=O)/C)/CCO)CC
• InChI: 1S/C17H27N3O3S2/c1-4-5-6-9-24-25-16(7-8-21)13(2)20(12-22)11-15-10-18-14(3)19-17(15)23/h10,12,21H,4-9,11H2,1-3H3,(H,18,19,23)/b16-13-
• InChIKey: VZQKQFJEQRWLDJ-SSZFMOIBSA-N

Properties

• Density: 1.219g/cm³ (Cal.)