2-[3-(1-Isoquinolyloxy)Propyl]Aminoethanethiol Sulfate
[CAS# 41287-44-9]

Identification

• Name: 2-[3-(1-Isoquinolyloxy)Propyl]Aminoethanethiol Sulfate
• Synonyms: 1-[3-[2-(Sulfothio)Ethylamino]Propoxy]Isoquinoline; Ethanethiosulfuric Acid, 2-(3-(1-Isoquinolyloxy)Propyl)Amino-; S-2-((3-(1-Isoquinolyloxy)Propyl)Amino)Ethyl Hydrogen Thiosulfate
• Molecular Formula: C₁₄H₁₈N₂O₄S₂
• Molecular Weight: 342.43
• CAS Registry Number: 41287-44-9
• SMILES: C1=NC(=C2C(=C1)C=CC=C2)OCCCNCCS[S](=O)(=O)O
• InChI: 1S/C14H18N2O4S2/c17-22(18,19)21-11-9-15-7-3-10-20-14-13-5-2-1-4-12(13)6-8-16-14/h1-2,4-6,8,15H,3,7,9-11H2,(H,17,18,19)
• InChIKey: PUCADCOCQQBSLL-UHFFFAOYSA-N

Properties

• Density: 1.38g/cm³ (Cal.)