EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:183331 - N1-morpholinocarbothioylbenzamide

ChEBI IDCHEBI:183331
ChEBI NameN1-morpholinocarbothioylbenzamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14N2O2S
Net Charge0
Average Mass250.323
Monoisotopic Mass250.07760
SMILESO=C(/N=C(\S)N1CCOCC1)c1ccccc1
InChIInChI=1S/C12H14N2O2S/c15-11(10-4-2-1-3-5-10)13-12(17)14-6-8-16-9-7-14/h1-5H,6-9H2,(H,13,15,17)
InChIKeyOHHBPERPNJLQLV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
brain (BTO:0000142) MetaboLights (MTBLS3637)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N1-morpholinocarbothioylbenzamide (CHEBI:183331) is a benzoic acids (CHEBI:22723)
IUPAC Name 
N-benzoylmorpholine-4-carboximidothioic acid
Manual XrefsDatabases
606614ChemSpider