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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > sulfonamide > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfonic acid derivative > sulfonamide > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfonic acid derivative > sulfonamide > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > sulfonamide > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > secondary amino compound > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > secondary amino compound > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
organobromine compound > bromobenzenes > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > isoquinolines > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
organic heterocyclic compound > organonitrogen heterocyclic compound > isoquinolines > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
organic heterocyclic compound > organic heteropolycyclic compound > isoquinolines > n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide

Preferred term

n-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide  

Type

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

Broader concept

Narrower concepts

charge

  • 0

formula

  • C20H20BrN3O2S

has_role

inchi

  • InChI=1S/C20H20BrN3O2S/c21-18-8-6-16(7-9-18)3-2-11-22-13-14-24-27(25,26)20-5-1-4-17-15-23-12-10-19(17)20/h1-10,12,15,22,24H,11,13-14H2

inchikey

  • ZKZXNDJNWUTGDK-UHFFFAOYSA-N

is_conjugate_base_of

mass

  • 446.360

monoisotopicmass

  • 445.04596

smiles

  • [H]C(CNCCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2)=C([H])C1=CC=C(Br)C=C1

subset

  • 3_STAR

synonym EXACT

  • N-(2-{[3-(4-bromophenyl)prop-2-en-1-yl]amino}ethyl)isoquinoline-5-sulfonamide

synonym RELATED

  • H 89
  • H-89
  • H89
  • N-[2-[[3-(4-bromophenyl)-2-propen-1-yl]amino]ethyl]-5-isoquinolinesulfonamide
  • N-[2-(4-bromocinnamylamino)ethyl]-5-isoquinoline sulfonamide
  • protein kinase inhibitor H89

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:47495

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