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CHEBI:228479 - ethyl 2-amino-8H-indeno[2,1-b]thiophene-3-carboxylate

ChEBI IDCHEBI:228479
ChEBI Nameethyl 2-amino-8H-indeno[2,1-b]thiophene-3-carboxylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H13NO2S
Net Charge0
Average Mass259.330
Monoisotopic Mass259.06670
SMILESCCOC(=O)c1c(N)sc2c1-c1ccccc1C2
InChIInChI=1S/C14H13NO2S/c1-2-17-14(16)12-11-9-6-4-3-5-8(9)7-10(11)18-13(12)15/h3-6H,2,7,15H2,1H3
InChIKeyXUJFNCKOASSEEU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
ethyl 2-amino-8H-indeno[2,1-b]thiophene-3-carboxylate (CHEBI:228479) is a aromatic amine (CHEBI:33860)
ethyl 2-amino-8H-indeno[2,1-b]thiophene-3-carboxylate (CHEBI:228479) is a thiophenes (CHEBI:26961)
IUPAC Name 
ethyl 2-amino-4H-indeno[2,1-b]thiophene-1-carboxylate
Manual XrefsDatabases
2104330ChemSpider