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CHEBI:121211 - [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[2-(ethylthio)phenyl]methanone

Default Structure
ChEBI IDCHEBI:121211
ChEBI Name[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[2-(ethylthio)phenyl]methanone
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FormulaC21H24N2O3S
Net Charge0
Average Mass384.501
Monoisotopic Mass384.15076
SMILESCCSc1ccccc1C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1
InChIInChI=1S/C21H24N2O3S/c1-2-27-20-6-4-3-5-17(20)21(24)23-11-9-22(10-12-23)14-16-7-8-18-19(13-16)26-15-25-18/h3-8,13H,2,9-12,14-15H2,1H3
InChIKeyKBSRJCKRTGVLKD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[2-(ethylthio)phenyl]methanone (CHEBI:121211) is a carbonyl compound (CHEBI:36586)
Manual XrefsDatabases
LSM-32654LINCS