EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:228602 - N1-(2-amino-2-oxoethyl)-2-(isopropylthio)acetamide

ChEBI IDCHEBI:228602
ChEBI NameN1-(2-amino-2-oxoethyl)-2-(isopropylthio)acetamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H14N2O2S
Net Charge0
Average Mass190.268
Monoisotopic Mass190.07760
SMILESCC(C)SCC(=O)NCC(N)=O
InChIInChI=1S/C7H14N2O2S/c1-5(2)12-4-7(11)9-3-6(8)10/h5H,3-4H2,1-2H3,(H2,8,10)(H,9,11)
InChIKeyMGNJFPOCCNEDBU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
N1-(2-amino-2-oxoethyl)-2-(isopropylthio)acetamide (CHEBI:228602) is a carboximidic acid (CHEBI:48378)
IUPAC Name 
2-[(2-propan-2-ylsulanylacetyl)amino]acetamide
Manual XrefsDatabases
2011250ChemSpider