5-Bromo-3-[[(2S)-1-methyl-2-pyrrolidinyl]methyl]-1H-indole

CAS: 208464-41-9

Ref. TR-B688725

Product Information

• Name: 5-Bromo-3-[[(2S)-1-methyl-2-pyrrolidinyl]methyl]-1H-indole
• Synonyms: 5-Bromo-3-[[(2S)-1-Methyl-2-Pyrrolidinyl]Methyl]-1H-Indole Impurity
• Brand: TRC

Description

Applications 5-Bromo-3-[[(2S)-1-methyl-2-pyrrolidinyl]methyl]-1H-indole is an intermediate in the synthesis of ent-Eletriptan (E505005), an enantiomeric impurity of the serotonin 5-HTIB/ID receptor agonist Eletriptan (E505000).
References Orita, A., et al.: Green Chem., 3, 13 (2001);

Chemical properties

• Molecular weight: 581.506
• Formula: C₂₃H₂₃N₃O₁₃S
• Color/Form: Neat
• InChI: InChI=1S/C23H23N3O13S/c1-10(27)35-16-17(36-11(2)28)19(37-12(3)29)22(39-18(16)21(31)34-4)38-14-8-6-5-7-13(14)20(30)25-23-24-9-15(40-23)26(32)33/h5-9,16-19,22H,1-4H3,(H,24,25,30)/t16-,17?,18?,19?,22-/m0/s1
• SMILES: COC(=O)C1O[C@H](Oc2ccccc2C(=O)Nc2ncc([N+](=O)[O-])s2)C(OC(C)=O)C(OC(C)=O)[C@@H]1OC(C)=O