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Substance Name: 4(3H)-Quinazolinone, 2-(((1,4,5,6-tetrahydro-2-pyrimidinyl)thio)methyl)-3-o-tolyl-, monohydrobromide
RN: 61554-95-8
InChIKey: KPXBIIMXVANZCX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H20-N4-O-S.Br-H

Molecular Weight

  • 445.383
 
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Names and Synonyms

  • 4(3H)-Quinazolinone, 2-(((1,4,5,6-tetrahydro-2-pyrimidinyl)thio)methyl)-3-o-tolyl-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 61554-95-8

System Generated Number

  • 0061554958

Molecular Formulas

Molecular Formula

  • C20-H20-N4-O-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C20-H20-N4-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C20H20N4OS.BrH/c1-14-7-2-5-10-17(14)24-18(13-26-20-21-11-6-12-22-20)23-16-9-4-3-8-15(16)19(24)25;/h2-5,7-10H,6,11-13H2,1H3,(H,21,22);1H

InChIKey

KPXBIIMXVANZCX-UHFFFAOYSA-N

Smiles

c1cc2c(c(n(c(CSC3=NCCCN3)n2)c2ccccc2C)=O)cc1.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.