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CHEBI:228825 - Ethyl 2-cyano-3-(tetrahydro-3-thiophenylamino)acrylate

ChEBI IDCHEBI:228825
ChEBI NameEthyl 2-cyano-3-(tetrahydro-3-thiophenylamino)acrylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H14N2O2S
Net Charge0
Average Mass226.301
Monoisotopic Mass226.07760
SMILESCCOC(=O)C(C#N)=CNC1CCSC1
InChIInChI=1S/C10H14N2O2S/c1-2-14-10(13)8(5-11)6-12-9-3-4-15-7-9/h6,9,12H,2-4,7H2,1H3
InChIKeyVSPJQAMBRMNWGY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
Ethyl 2-cyano-3-(tetrahydro-3-thiophenylamino)acrylate (CHEBI:228825) is a tetrahydrothiophenes (CHEBI:48224)
IUPAC Name 
ethyl 2-cyano-3-(thiolan-3-ylamino)prop-2-enoate
Manual XrefsDatabases
26462078ChemSpider