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Substance Name: Pseudourea, 1-phenyl-2-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl)-2-thio-, monohydriodide
RN: 3810-30-8
InChIKey: GXMROXORHFDXNV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H18-N6-O2-S.H-I

Molecular Weight

  • 486.332
 
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Names and Synonyms

Synonym

  • T49

Systematic Name

  • Pseudourea, 1-phenyl-2-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl)-2-thio-, monohydriodide

Registry Numbers

CAS Registry Number

  • 3810-30-8

System Generated Number

  • 0003810308

Molecular Formulas

Molecular Formula

  • C16-H18-N6-O2-S.H-I

Molecular Formula Fragments

  • C16-H18-N6-O2-S
  • COMPONENT
  • H-I

Structure Descriptors

InChI

1S/C16H18N6O2S.HI/c1-20-13-12(14(23)21(2)16(20)24)22(10-18-13)8-9-25-15(17)19-11-6-4-3-5-7-11;/h3-7,10H,8-9H2,1-2H3,(H2,17,19);1H

InChIKey

GXMROXORHFDXNV-UHFFFAOYSA-N

Smiles

N(=C(\SCCn1cnc2n(c(n(c(c12)=O)C)=O)C)N)\c1ccccc1.I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 238mg/kg (238mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: EXCITEMENT
Archivum Immunologiae et Therapiae Experimentalis. Vol. 10, Pg. 141, 1962.