CHEBI:61485 - thiopental(1−)

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ChEBI Name thiopental(1−)
ChEBI ID CHEBI:61485
ChEBI ASCII Name thiopental(1-)
Definition A thiolate anion resulting from the removal of a proton from one of the nitrogens of thiopental and tautomerisation.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C11H17N2O2S
Net Charge -1
Average Mass 241.33000
Monoisotopic Mass 241.10162
InChI InChI=1S/C11H18N2O2S/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)/p-1
InChIKey IUJDSEJGGMCXSG-UHFFFAOYSA-M
SMILES CCCC(C)C1(CC)C(=O)NC([S-])=NC1=O
ChEBI Ontology
Outgoing thiopental(1−) (CHEBI:61485) is a thiolate anion (CHEBI:50539)
thiopental(1−) (CHEBI:61485) is conjugate base of thiopental (CHEBI:102166)
Incoming thiopental sodium (CHEBI:9561) has part thiopental(1−) (CHEBI:61485)
thiopental (CHEBI:102166) is conjugate acid of thiopental(1−) (CHEBI:61485)
IUPAC Name
5-ethyl-4,6-dioxo-5-(pentan-2-yl)-1,4,5,6-tetrahydropyrimidine-2-thiolate
Synonyms Sources
pentothiobarbital(1−) ChEBI
thiopentobarbitone(1−) ChEBI
thiopentone(1−) ChEBI
Last Modified
24 February 2011