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Substance Name: 2H-Imidazo(2,1-b)(1,3,4)thiadiazin-7(6H)-one, 3-(3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)-, hydrobromide
RN: 117829-33-1
InChIKey: VQCDCEULRZROPR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H25-N3-O2-S.Br-H

Molecular Weight

  • 440.4034
 
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Names and Synonyms

Synonym

  • 3-(3,5-Di-t-butyl-4-hydroxyphenyl)-7-oxo-6,7-dihydro-2H-imidazo(2,1-b)(1,3,4)thiadiazine HBr

Systematic Name

  • 2H-Imidazo(2,1-b)(1,3,4)thiadiazin-7(6H)-one, 3-(3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)-, hydrobromide

Registry Numbers

CAS Registry Number

  • 117829-33-1

System Generated Number

  • 0117829331

Molecular Formulas

Molecular Formula

  • C19-H25-N3-O2-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C19-H25-N3-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C19H25N3O2S.BrH/c1-18(2,3)12-7-11(8-13(16(12)24)19(4,5)6)14-10-25-17-20-15(23)9-22(17)21-14;/h7-8,24H,9-10H2,1-6H3;1H

InChIKey

VQCDCEULRZROPR-UHFFFAOYSA-N

Smiles

CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C2=NN3CC(=O)N=C3SC2.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   United States Patent Document. Vol. #4891374,