Lergotrile Mesylate
[CAS# 51473-23-5]

Identification

• Name: Lergotrile Mesylate
• Synonyms: 2-Chloro-6-Methylergoline-8Beta-Acetonitrile Monomethanesulphonate; D-2-Chloro-6-Methylergoline-8-Beta-Acetonitrile Methanesulfonic Acid Salt
• Molecular Formula: C₁₈H₂₂ClN₃O₃S
• Molecular Weight: 395.90
• CAS Registry Number: 51473-23-5
• EINECS: 257-225-4
• SMILES: C2=CC=C1[NH]C(=C4C1=C2C3C(N(CC(C3)CC#N)C)C4)Cl.C[S](=O)(=O)O
• InChI: 1S/C17H18ClN3.CH4O3S/c1-21-9-10(5-6-19)7-12-11-3-2-4-14-16(11)13(8-15(12)21)17(18)20-14;1-5(2,3)4/h2-4,10,12,15,20H,5,7-9H2,1H3;1H3,(H,2,3,4)
• InChIKey: WXHDJVDIJQDJMK-UHFFFAOYSA-N