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Substance Name: Pseudourea, 1,3-dibutyl-2-((3,4-dihydro-4-oxo-3-o-tolylquinazolin-2-yl)methyl)-2-thio-, monohydrobromide
RN: 61554-91-4
InChIKey: KDQLVQWWDSWQKB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H32-N4-O-S.Br-H

Molecular Weight

  • 517.5327
 
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Names and Synonyms

Synonym

  • N,N'-Dibutyl-S-(3-(o-tolyl)-4(3H)-oxoquinazolin-2-ylmethyl)thiouronium bromide

Systematic Name

  • Pseudourea, 1,3-dibutyl-2-((3,4-dihydro-4-oxo-3-o-tolylquinazolin-2-yl)methyl)-2-thio-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 61554-91-4

System Generated Number

  • 0061554914

Molecular Formulas

Molecular Formula

  • C25-H32-N4-O-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C25-H32-N4-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C25H32N4OS.BrH/c1-4-6-16-26-25(27-17-7-5-2)31-18-23-28-21-14-10-9-13-20(21)24(30)29(23)22-15-11-8-12-19(22)3;/h8-15H,4-7,16-18H2,1-3H3,(H,26,27);1H

InChIKey

KDQLVQWWDSWQKB-UHFFFAOYSA-N

Smiles

CCCCN/C(=N/CCCC)/SCc1nc2ccccc2c(=O)n1c3ccccc3C.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 379, 1977.