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CHEBI:43679 - 4-[3-(4-benzylpiperidin-1-yl)propanoyl]-7-methoxy-2,3,4,5-tetrahydro-1,4-benzothiazepine

ChEBI IDCHEBI:43679
ChEBI Name4-[3-(4-benzylpiperidin-1-yl)propanoyl]-7-methoxy-2,3,4,5-tetrahydro-1,4-benzothiazepine
Stars
Last Modified4 March 2008
DownloadsMolfile
FormulaC25H32N2O2S
Net Charge0
Average Mass424.610
Monoisotopic Mass424.21845
SMILES[H]c1c([H])c([H])c(C([H])([H])C2([H])C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])C(=O)N3C([H])([H])c4c([H])c(OC([H])([H])[H])c([H])c([H])c4SC([H])([H])C3([H])[H])C([H])([H])C2([H])[H])c([H])c1[H]
InChIInChI=1S/C25H32N2O2S/c1-29-23-7-8-24-22(18-23)19-27(15-16-30-24)25(28)11-14-26-12-9-21(10-13-26)17-20-5-3-2-4-6-20/h2-8,18,21H,9-17,19H2,1H3
InChIKeyKCWGETCFOVJEPI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[3-(4-benzylpiperidin-1-yl)propanoyl]-7-methoxy-2,3,4,5-tetrahydro-1,4-benzothiazepine (CHEBI:43679) is a benzothiazepine (CHEBI:48684)
4-[3-(4-benzylpiperidin-1-yl)propanoyl]-7-methoxy-2,3,4,5-tetrahydro-1,4-benzothiazepine (CHEBI:43679) is a piperidines (CHEBI:26151)
Synonyms  Source
4-[3-{1-(4-BENZYL)PIPERODINYL}PROPIONYL]-7-METHOXY-2,3,4,5-TERTRAHYDRO-1,4-BENZOTHIAZEPINEPDBeChem
4-[3-(4-benzylpiperidin-1-yl)propanoyl]-7-methoxy-2,3,4,5-tetrahydro-1,4-benzothiazepinePDBeChem
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