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CHEBI:134392 - 3-amino-7-(4-methylpiperazin-1-yl)-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile

ChEBI IDCHEBI:134392
ChEBI Name3-amino-7-(4-methylpiperazin-1-yl)-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile
Stars
ASCII Name3-amino-7-(4-methylpiperazin-1-yl)-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile
DefinitionAn imidazoindole that is 9H-imidazo[1,2-a]indole which is substituted at positions 2, 3, 7, and 9 by cyano, amino, 4-methylpiperazin-1-yl, and oxo groups, respectively.
Last Modified13 April 2017
Submitterkalra
DownloadsMolfile
FormulaC16H16N6O
Net Charge0
Average Mass308.345
Monoisotopic Mass308.13856
SMILESCN1CCN(c2ccc3c(c2)C(=O)c2nc(C#N)c(N)n2-3)CC1
InChIInChI=1S/C16H16N6O/c1-20-4-6-21(7-5-20)10-2-3-13-11(8-10)14(23)16-19-12(9-17)15(18)22(13)16/h2-3,8H,4-7,18H2,1H3
InChIKeyUDCNQEVZQDDVEY-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)
3-amino-7-(4-methylpiperazin-1-yl)-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile (CHEBI:134392) is a N-arylpiperazine (CHEBI:46848)
3-amino-7-(4-methylpiperazin-1-yl)-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile (CHEBI:134392) is a N-methylpiperazine (CHEBI:46920)
3-amino-7-(4-methylpiperazin-1-yl)-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile (CHEBI:134392) is a imidazoindole (CHEBI:64547)
3-amino-7-(4-methylpiperazin-1-yl)-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile (CHEBI:134392) is a nitrile (CHEBI:18379)
3-amino-7-(4-methylpiperazin-1-yl)-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile (CHEBI:134392) is a primary amino compound (CHEBI:50994)
IUPAC Name 
3-amino-7-(4-methylpiperazin-1-yl)-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile