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Concept information

organooxygen compound > oxacycle > benzodioxoles > 6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-n2-(3-methylphenyl)-1,3,5-triazine-2,4-diamine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzodioxoles > 6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-n2-(3-methylphenyl)-1,3,5-triazine-2,4-diamine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzodioxoles > 6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-n2-(3-methylphenyl)-1,3,5-triazine-2,4-diamine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzodioxoles > 6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-n2-(3-methylphenyl)-1,3,5-triazine-2,4-diamine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzodioxoles > 6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-n2-(3-methylphenyl)-1,3,5-triazine-2,4-diamine

Preferred term

6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-n2-(3-methylphenyl)-1,3,5-triazine-2,4-diamine  

Type

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

Broader concept

charge

  • 0

formula

  • C23H27N7O2

inchi

  • InChI=1S/C23H27N7O2/c1-16-3-2-4-18(11-16)25-23-27-21(26-22(24)28-23)14-30-9-7-29(8-10-30)13-17-5-6-19-20(12-17)32-15-31-19/h2-6,11-12H,7-10,13-15H2,1H3,(H3,24,25,26,27,28)

inchikey

  • XJSZPZODEYGCDW-UHFFFAOYSA-N

mass

  • 433.507

monoisotopicmass

  • 433.22262

smiles

  • CC1=CC(=CC=C1)NC2=NC(=NC(=N2)N)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:109012

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