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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > naphthalenes > 5-amino-1-(2-cyanoethyl)-3-(1-naphthalenylmethyl)-4-pyrazolecarbonitrile

Preferred term

5-amino-1-(2-cyanoethyl)-3-(1-naphthalenylmethyl)-4-pyrazolecarbonitrile  

Type

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

Broader concept

charge

  • 0

formula

  • C18H15N5

inchi

  • InChI=1S/C18H15N5/c19-9-4-10-23-18(21)16(12-20)17(22-23)11-14-7-3-6-13-5-1-2-8-15(13)14/h1-3,5-8H,4,10-11,21H2

inchikey

  • GIJOLWKRVUVZJW-UHFFFAOYSA-N

mass

  • 301.346

monoisotopicmass

  • 301.13275

smiles

  • C1=CC=C2C(=C1)C=CC=C2CC3=NN(C(=C3C#N)N)CCC#N

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:92794

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