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Substance Name: 4(3H)-Quinazolinone, 6-bromo-3-(5-((2-hydroxy-3-((4-methylphenyl)amino)propyl)thio)-1,3,4-thiadiazol-2-yl)-2-methyl-
RN: 135575-58-5
InChIKey: BIERMLYPIVYFNN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H20-Br-N5-O2-S2

Molecular Weight

  • 518.458
 
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Names and Synonyms

Synonym

  • BRN 4339723

Systematic Name

  • 4(3H)-Quinazolinone, 6-bromo-3-(5-((2-hydroxy-3-((4-methylphenyl)amino)propyl)thio)-1,3,4-thiadiazol-2-yl)-2-methyl-

Registry Numbers

CAS Registry Number

  • 135575-58-5

System Generated Number

  • 0135575585

Structure Descriptors

InChI

1S/C21H20BrN5O2S2/c1-12-3-6-15(7-4-12)23-10-16(28)11-30-21-26-25-20(31-21)27-13(2)24-18-8-5-14(22)9-17(18)19(27)29/h3-9,16,23,28H,10-11H2,1-2H3

InChIKey

BIERMLYPIVYFNN-UHFFFAOYSA-N

Smiles

c1c(cc2c(c1)nc(n(c2=O)c1sc(nn1)SC[C@@H](CNc1ccc(cc1)C)O)C)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 41, Pg. 514, 1991.