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CHEBI:228619 - N1-(1,3-benzodioxol-5-yl)-2-[(1-methyl-1H-imidazol-2-yl)thio]acetamide

ChEBI IDCHEBI:228619
ChEBI NameN1-(1,3-benzodioxol-5-yl)-2-[(1-methyl-1H-imidazol-2-yl)thio]acetamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H13N3O3S
Net Charge0
Average Mass291.332
Monoisotopic Mass291.06776
SMILESCn1ccnc1SCC(=O)Nc1ccc2c(c1)OCO2
InChIInChI=1S/C13H13N3O3S/c1-16-5-4-14-13(16)20-7-12(17)15-9-2-3-10-11(6-9)19-8-18-10/h2-6H,7-8H2,1H3,(H,15,17)
InChIKeySTSKLFSXXFQNLC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
N1-(1,3-benzodioxol-5-yl)-2-[(1-methyl-1H-imidazol-2-yl)thio]acetamide (CHEBI:228619) is a benzodioxoles (CHEBI:38298)
IUPAC Name 
N-(1,3-benzodioxol-5-yl)-2-(1-methylimidazol-2-yl)sulanylacetamide
Manual XrefsDatabases
619383ChemSpider