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Substance Name: 4(3H)-Quinazolinone, 3-(5-((2-hydroxy-3-((4-methylphenyl)amino)propyl)thio)-1,3,4-thiadiazol-2-yl)-2-methyl-
RN: 135575-55-2
InChIKey: OPNKCSPYWLUCCM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H21-N5-O2-S2

Molecular Weight

  • 439.562
 
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Names and Synonyms

Synonym

  • BRN 4338688

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 135575-55-2

System Generated Number

  • 0135575552

Structure Descriptors

InChI

1S/C21H21N5O2S2/c1-13-7-9-15(10-8-13)22-11-16(27)12-29-21-25-24-20(30-21)26-14(2)23-18-6-4-3-5-17(18)19(26)28/h3-10,16,22,27H,11-12H2,1-2H3

InChIKey

OPNKCSPYWLUCCM-UHFFFAOYSA-N

Smiles

c1ccc2c(n(c(nc2c1)C)c1sc(nn1)SC[C@@H](CNc1ccc(cc1)C)O)=O

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.