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CHEBI:41245 - 1-[2-(4-{3-[4-(2-pyrrolidin-1-ylethoxy)benzyl]-1-benzothiophen-2-yl}phenoxy)ethyl]pyrrolidine

ChEBI IDCHEBI:41245
ChEBI Name1-[2-(4-{3-[4-(2-pyrrolidin-1-ylethoxy)benzyl]-1-benzothiophen-2-yl}phenoxy)ethyl]pyrrolidine
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Last Modified17 October 2009
DownloadsMolfile
FormulaC33H38N2O2S
Net Charge0
Average Mass526.746
Monoisotopic Mass526.26540
SMILES[H]c1c([H])c(-c2sc3c([H])c([H])c([H])c([H])c3c2C([H])([H])c2c([H])c([H])c(OC([H])([H])C([H])([H])N3C([H])([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c2[H])c([H])c([H])c1OC([H])([H])C([H])([H])N1C([H])([H])C([H])([H])C([H])([H])C1([H])[H]
InChIInChI=1S/C33H38N2O2S/c1-2-8-32-30(7-1)31(25-26-9-13-28(14-10-26)36-23-21-34-17-3-4-18-34)33(38-32)27-11-15-29(16-12-27)37-24-22-35-19-5-6-20-35/h1-2,7-16H,3-6,17-25H2
InChIKeyMBVYSLWWSSHIRS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[2-(4-{3-[4-(2-pyrrolidin-1-ylethoxy)benzyl]-1-benzothiophen-2-yl}phenoxy)ethyl]pyrrolidine (CHEBI:41245) is a N-alkylpyrrolidine (CHEBI:46775)
1-[2-(4-{3-[4-(2-pyrrolidin-1-ylethoxy)benzyl]-1-benzothiophen-2-yl}phenoxy)ethyl]pyrrolidine (CHEBI:41245) is a 1-benzothiophenes (CHEBI:38836)
Synonyms  Source
3-[4-(2-PYRROLIDIN-1-YL-ETHOXY)-BENZYL]-2-4-(2-PYRROLIDIN-1-YL-ETHOXY)-PHENYL] -BENZO[B]THIOPHENEPDBeChem
1-[2-(4-{3-[4-(2-pyrrolidin-1-ylethoxy)benzyl]-1-benzothiophen-2-yl}phenoxy)ethyl]pyrrolidinePDBeChem
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