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Substance Name: Thieno(2,3-d)-1,2,3-triazin-4(3H)-one, 3-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-, monohydrochloride
RN: 91532-26-2
InChIKey: BRBLFSBWXBNVEV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H20-Cl-N5-O-S.Cl-H

Molecular Weight

  • 426.3699
 
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Names and Synonyms

Synonym

  • (((Chloro-3 phenyl)-4-piperazinyl-1)-3 propyl)-3-3H-thieno(2,3-d)triazine-1,2,3 one-4 HCl

Systematic Name

  • Thieno(2,3-d)-1,2,3-triazin-4(3H)-one, 3-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 91532-26-2

System Generated Number

  • 0091532262

Molecular Formulas

Molecular Formula

  • C18-H20-Cl-N5-O-S.Cl-H

Molecular Formula Fragments

  • C18-H20-Cl-N5-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H20ClN5OS.ClH/c19-14-3-1-4-15(13-14)23-10-8-22(9-11-23)6-2-7-24-18(25)16-5-12-26-17(16)20-21-24;/h1,3-5,12-13H,2,6-11H2;1H

InChIKey

BRBLFSBWXBNVEV-UHFFFAOYSA-N

Smiles

Cl.Clc1cccc(c1)N2CCN(CCCN3N=Nc4sccc4C3=O)CC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1060mg/kg (1060mg/kg)   United States Patent Document. Vol. #4552878,