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CHEBI:9561 - thiopental sodium

ChEBI IDCHEBI:9561
ChEBI Namethiopental sodium
Stars
DefinitionAn organic sodium salt having thiopental(1−) as the counter-ion.
Last Modified2 March 2011
DownloadsMolfile
FormulaC11H17N2O2S.Na
Net Charge0
Average Mass264.326
Monoisotopic Mass264.09084
SMILESCCCC(C)C1(CC)C(=O)N=C([S-])NC1=O.[Na+]
InChIInChI=1S/C11H18N2O2S.Na/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15;/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16);/q;+1/p-1
InChIKeyAWLILQARPMWUHA-UHFFFAOYSA-M
Wikipedia
Roles Classification
Application:
ChEBI Ontology
Outgoing Relation(s)
thiopental sodium (CHEBI:9561) has part thiopental(1−) (CHEBI:61485)
thiopental sodium (CHEBI:9561) has role intravenous anaesthetic (CHEBI:38877)
thiopental sodium (CHEBI:9561) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
sodium 5-ethyl-4,6-dioxo-5-(pentan-2-yl)-1,4,5,6-tetrahydropyrimidine-2-thiolate
INNs  Source
thiopental sodiumChemIDplus
tiopental sodicoChemIDplus
thiopentalum natricumChemIDplus
thiopental sodiqueChemIDplus
Synonyms  Source
sodium 5-ethyl-5-(1-methylbutyl)-2-thiobarbiturateChemIDplus
sodium (±)-5-ethyl-5-(1-methylbutyl)-2-thiobarbiturateChemIDplus
monosodium 5-ethyl-5-(1-methylbutyl) thiobarbiturateChemIDplus
penthiobarbital sodiumChemIDplus
thiopentone sodiumChEBI
sodium thiopentoneChemIDplus
Manual XrefsDatabases
D00714KEGG DRUG
US2153729Patent
US2876225Patent
DB00599DrugBank
ThiopentalWikipedia
Registry NumbersSources
Reaxys:5198928Reaxys
CAS:71-73-8KEGG DRUG
CAS:71-73-8ChemIDplus