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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > quinolines > 3-[(6-bromo-3-butyl-2-methyl-4-quinolinyl)thio]propanenitrile
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > quinolines > 3-[(6-bromo-3-butyl-2-methyl-4-quinolinyl)thio]propanenitrile
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > quinolines > 3-[(6-bromo-3-butyl-2-methyl-4-quinolinyl)thio]propanenitrile
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > quinolines > 3-[(6-bromo-3-butyl-2-methyl-4-quinolinyl)thio]propanenitrile
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > quinolines > 3-[(6-bromo-3-butyl-2-methyl-4-quinolinyl)thio]propanenitrile
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > quinolines > 3-[(6-bromo-3-butyl-2-methyl-4-quinolinyl)thio]propanenitrile
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > quinolines > 3-[(6-bromo-3-butyl-2-methyl-4-quinolinyl)thio]propanenitrile
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > halide > organohalogen compound > 3-[(6-bromo-3-butyl-2-methyl-4-quinolinyl)thio]propanenitrile

Preferred term

3-[(6-bromo-3-butyl-2-methyl-4-quinolinyl)thio]propanenitrile  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C17H19BrN2S

inchi

  • InChI=1S/C17H19BrN2S/c1-3-4-6-14-12(2)20-16-8-7-13(18)11-15(16)17(14)21-10-5-9-19/h7-8,11H,3-6,10H2,1-2H3

inchikey

  • DXCDMEQEVRYHCJ-UHFFFAOYSA-N

mass

  • 363.316

monoisotopicmass

  • 362.04523

smiles

  • CCCCC1=C(C2=C(C=CC(=C2)Br)N=C1C)SCCC#N

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:109239

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