CHEBI:9544 - thiethylperazine

ChEBI IDCHEBI:9544
ChEBI Namethiethylperazine
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DefinitionA member of the class of phenothiazines that is perazine substituted by a ethylsulfanyl group at position 2.
Last Modified22 February 2017
DownloadsMolfile
FormulaC22H29N3S2
Net Charge0
Average Mass399.629
Monoisotopic Mass399.18029
SMILESCCSc1ccc2c(c1)N(CCCN1CCN(C)CC1)c1ccccc1S2
InChIInChI=1S/C22H29N3S2/c1-3-26-18-9-10-22-20(17-18)25(19-7-4-5-8-21(19)27-22)12-6-11-24-15-13-23(2)14-16-24/h4-5,7-10,17H,3,6,11-16H2,1-2H3
InChIKeyXCTYLCDETUVOIP-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
dopaminergic antagonist  A drug that binds to but does not activate dopamine receptors, thereby blocking the actions of dopamine or exogenous agonists.
muscarinic antagonist  A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
histamine antagonist  Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
Applications:
antiemetic  A drug used to prevent nausea or vomiting. An antiemetic may act by a wide range of mechanisms: it might affect the medullary control centres (the vomiting centre and the chemoreceptive trigger zone) or affect the peripheral receptors.
dopaminergic antagonist  A drug that binds to but does not activate dopamine receptors, thereby blocking the actions of dopamine or exogenous agonists.
muscarinic antagonist  A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
histamine antagonist  Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
ChEBI Ontology
Outgoing Relation(s)
thiethylperazine (CHEBI:9544) has functional parent perazine (CHEBI:59118)
thiethylperazine (CHEBI:9544) has role antiemetic (CHEBI:50919)
thiethylperazine (CHEBI:9544) has role dopaminergic antagonist (CHEBI:48561)
thiethylperazine (CHEBI:9544) has role histamine antagonist (CHEBI:37956)
thiethylperazine (CHEBI:9544) has role muscarinic antagonist (CHEBI:48876)
thiethylperazine (CHEBI:9544) has role phenothiazine antipsychotic drug (CHEBI:37930)
thiethylperazine (CHEBI:9544) has role serotonergic antagonist (CHEBI:48279)
thiethylperazine (CHEBI:9544) is a N-methylpiperazine (CHEBI:46920)
thiethylperazine (CHEBI:9544) is a phenothiazines (CHEBI:38093)
Incoming Relation(s)
thiethylperazine maleate (CHEBI:32216) has part thiethylperazine (CHEBI:9544)
IUPAC Name 
2-(ethylsulfanyl)-10-[3-(4-methylpiperazin-1-yl)propyl]-10H-phenothiazine
INNs  Source
thiethylperazineChEBI
thiéthylpérazineChEBI
tietilperazinaChEBI
thiethylperazinumChEBI
Synonyms  Source
ThiethylperazineKEGG COMPOUND
EthylthioperazineKEGG COMPOUND
3-Ethylmercapto-10-(1'-methylpiperazinyl-4'-propyl)phenothiazineChemIDplus
2-(ethylthio)-10-[3-(4-methylpiperazin-1-yl)propyl]-10H-phenothiazineChEBI
Manual XrefsDatabases
C07132KEGG COMPOUND
D02354KEGG DRUG
DB00372DrugBank
ThiethylperazineWikipedia
HMDB0014516HMDB
LSM-3556LINCS
2630DrugCentral
Registry NumbersSources
Reaxys:52127Reaxys
CAS:1420-55-9ChemIDplus
Citations