1-[1-(3-Isothiocyanatophenyl)cyclohexyl]piperidine methanesulfonate (1:1)
[CAS# 99287-12-4]

Identification

• Classification: Biochemical >> Common amino acids and protein drugs
• Name: 1-[1-(3-Isothiocyanatophenyl)cyclohexyl]piperidine methanesulfonate (1:1)
• Synonyms: 1-(1-[3-Isothiocyanato]phenyl)cyclohexylpiperidine methansulfonate; 1-[1-(3-Isothiocyanato)phenyl]cyclohexylpiperidine methanesulfonate salt; Metaphit
• Molecular Formula: C₁₉H₂₈N₂O₃S₂
• Molecular Weight: 396.57
• CAS Registry Number: 99287-12-4
• SMILES: CS(=O)(=O)O.C1CCC(CC1)(C2=CC(=CC=C2)N=C=S)N3CCCCC3
• InChI: 1S/C18H24N2S.CH4O3S/c21-15-19-17-9-7-8-16(14-17)18(10-3-1-4-11-18)20-12-5-2-6-13-20;1-5(2,3)4/h7-9,14H,1-6,10-13H2;1H3,(H,2,3,4)
• InChIKey: ZASHKPXYYPYQRI-UHFFFAOYSA-N