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CHEBI:116936 - 2,6-diamino-4-(1-phenylethyl)-4H-thiopyran-3,5-dicarbonitrile

ChEBI IDCHEBI:116936
ChEBI Name2,6-diamino-4-(1-phenylethyl)-4H-thiopyran-3,5-dicarbonitrile
Stars
ASCII Name2,6-diamino-4-(1-phenylethyl)-4H-thiopyran-3,5-dicarbonitrile
Last Modified7 March 2016
DownloadsMolfile
FormulaC15H14N4S
Net Charge0
Average Mass282.372
Monoisotopic Mass282.09392
SMILESCC(c1ccccc1)C1C(C#N)=C(N)SC(N)=C1C#N
InChIInChI=1S/C15H14N4S/c1-9(10-5-3-2-4-6-10)13-11(7-16)14(18)20-15(19)12(13)8-17/h2-6,9,13H,18-19H2,1H3
InChIKeyNOCKQMOIGSIBGQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,6-diamino-4-(1-phenylethyl)-4H-thiopyran-3,5-dicarbonitrile (CHEBI:116936) is a nitrile (CHEBI:18379)
2,6-diamino-4-(1-phenylethyl)-4H-thiopyran-3,5-dicarbonitrile (CHEBI:116936) is a organosulfur heterocyclic compound (CHEBI:38106)
IUPAC Name 
2,6-diamino-4-(1-phenylethyl)-4H-thiopyran-3,5-dicarbonitrile
Synonym  Source
BRD-A02033528ChEBI
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