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CHEBI:111253 - 5-(2-chloroanilino)-3-oxo-4-isothiazolecarbonitrile

ChEBI IDCHEBI:111253
ChEBI Name5-(2-chloroanilino)-3-oxo-4-isothiazolecarbonitrile
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DownloadsMolfile
FormulaC10H6ClN3OS
Net Charge0
Average Mass251.698
Monoisotopic Mass250.99201
SMILESN#Cc1c(Nc2ccccc2Cl)snc1=O
InChIInChI=1S/C10H6ClN3OS/c11-7-3-1-2-4-8(7)13-10-6(5-12)9(15)14-16-10/h1-4,13H,(H,14,15)
InChIKeyDDSXGKISGSWSIE-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
5-(2-chloroanilino)-3-oxo-4-isothiazolecarbonitrile (CHEBI:111253) is a substituted aniline (CHEBI:48975)
Manual XrefsDatabases
LSM-22709LINCS