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Substance Name: Pyrano(3,4-d)imidazole, 1(or 3),4,6,7-tetrahydro-4-((dibenzylamino)methyl)-
RN: 95857-75-3
InChIKey: PHCMNKVFCIYTRW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N3-O.2C4-H4-O4

Molecular Weight

  • 333.4327
 
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Names and Synonyms

Synonyms

  • 4-((Dibenzylamino)methyl)-1(or 3),4,6,7-tetrahydropyrano(3,4-d)imidazole fumarate (1:2)
  • 4-(N,N-Dibenzylaminomethyl)-1(3),4,6,7-tetrahydro-1(3)H-pyrano(3,4-d)imidazole difumarate
  • Pyrano(3,4-d)imidazole-4-methanamine, 1,4,6,7-tetrahydro-N,N-bis(phenylmethyl)-

Systematic Name

  • Pyrano(3,4-d)imidazole, 1(or 3),4,6,7-tetrahydro-4-((dibenzylamino)methyl)-

Registry Numbers

CAS Registry Number

  • 95857-75-3

System Generated Number

  • 0095857753

Molecular Formulas

Molecular Formula

  • C21-H23-N3-O.2C4-H4-O4

Molecular Formula Fragments

  • C21-H23-N3-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H23N3O/c1-3-7-17(8-4-1)13-24(14-18-9-5-2-6-10-18)15-20-21-19(11-12-25-20)22-16-23-21/h1-10,16,20H,11-15H2,(H,22,23)

InChIKey

PHCMNKVFCIYTRW-UHFFFAOYSA-N

Smiles

c12C(CN(Cc3ccccc3)Cc3ccccc3)OCCc2[nH]cn1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 400mg/kg (400mg/kg)   Farmaco, Edizione Scientifica. Vol. 41, Pg. 23, 1986.