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CHEBI:47283 - 3-[3-bromo-4-(pyrrolidin-1-ylmethyl)benzyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-6-ol

ChEBI IDCHEBI:47283
ChEBI Name3-[3-bromo-4-(pyrrolidin-1-ylmethyl)benzyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-6-ol
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC32H35BrN2O2S
Net Charge0
Average Mass591.615
Monoisotopic Mass590.16026
SMILES[H]Oc1c([H])c([H])c2c(C([H])([H])c3c([H])c([H])c(C([H])([H])N4C([H])([H])C([H])([H])C([H])([H])C4([H])[H])c(Br)c3[H])c(-c3c([H])c([H])c(OC([H])([H])C([H])([H])N4C([H])([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c3[H])sc2c1[H]
InChIInChI=1S/C32H35BrN2O2S/c33-30-20-23(5-6-25(30)22-35-15-3-4-16-35)19-29-28-12-9-26(36)21-31(28)38-32(29)24-7-10-27(11-8-24)37-18-17-34-13-1-2-14-34/h5-12,20-21,36H,1-4,13-19,22H2
InChIKeyQVDZMCVSIVITGR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[3-bromo-4-(pyrrolidin-1-ylmethyl)benzyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-6-ol (CHEBI:47283) is a N-alkylpyrrolidine (CHEBI:46775)
3-[3-bromo-4-(pyrrolidin-1-ylmethyl)benzyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-6-ol (CHEBI:47283) is a 1-benzothiophenes (CHEBI:38836)
3-[3-bromo-4-(pyrrolidin-1-ylmethyl)benzyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-6-ol (CHEBI:47283) is a organobromine compound (CHEBI:37141)
Synonyms  Source
3-[3-bromo-4-(pyrrolidin-1-ylmethyl)benzyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophene-6-olPDBeChem
3-(3-BROMO-4-PYRROLIDIN-1-YLMETHYL-BENZYL)-2-[4-PYRROLIDIN-1-YL-ETHOXY)-PHENYL]-BENZO[B]THIOPHEN-6-OLPDBeChem
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