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CHEBI:59117 - pacatal

ChEBI IDCHEBI:59117
ChEBI Namepacatal
Stars
DefinitionA phenothiazine derivative in which 10H-phenothiazine has an N-methylpiperidin-4-ylmethyl substituent at the N-10 position.
Last Modified31 May 2016
SubmitterSteve
DownloadsMolfile
FormulaC19H22N2S
Net Charge0
Average Mass310.466
Monoisotopic Mass310.15037
SMILESCN1CCC(CN2c3ccccc3Sc3ccccc32)CC1
InChIInChI=1S/C19H22N2S/c1-20-12-10-15(11-13-20)14-21-16-6-2-4-8-18(16)22-19-9-5-3-7-17(19)21/h2-9,15H,10-14H2,1H3
InChIKeyDLAKWHKNGHJWKA-UHFFFAOYSA-N
Roles Classification
Applications:
sedative  A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety.
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.
ChEBI Ontology
Outgoing Relation(s)
pacatal (CHEBI:59117) has parent hydride 10H-phenothiazine (CHEBI:37931)
pacatal (CHEBI:59117) has role antiemetic (CHEBI:50919)
pacatal (CHEBI:59117) has role sedative (CHEBI:35717)
pacatal (CHEBI:59117) is a phenothiazines (CHEBI:38093)
pacatal (CHEBI:59117) is a piperidines (CHEBI:26151)
IUPAC Name 
10-[(1-methylpiperidin-4-yl)methyl]-10H-phenothiazine
Synonym  Source
10-((1-Methyl-4-piperidyl)methyl)phenothiazineChemIDplus
Registry NumbersSources
Reaxys:1139633Reaxys
CAS:3772-71-2ChemIDplus
Citations