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Substance Name: Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide
RN: 15641-55-1
InChIKey: KSUQJIITRRYURI-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-Cl-N3-O-S.I

Molecular Weight

  • 541.878
 
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Names and Synonyms

  • Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide

Registry Numbers

CAS Registry Number

  • 15641-55-1

System Generated Number

  • 0015641551

Molecular Formulas

Molecular Formula

  • C22-H25-Cl-N3-O-S.I

Molecular Formula Fragments

  • C22-H25-Cl-N3-O-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C22H25ClN3OS.HI/c1-26(12-6-3-7-13-26)14-15-28-22-24-20-16-17(23)10-11-19(20)21(27)25(22)18-8-4-2-5-9-18;/h2,4-5,8-11,16H,3,6-7,12-15H2,1H3;1H/q+1;/p-1

InChIKey

KSUQJIITRRYURI-UHFFFAOYSA-M

Smiles

[N+]1(CCCCC1)(C)CCSc1nc2cc(ccc2c(n1c1ccccc1)=O)Cl.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 100mg/kg (100mg/kg)   Bollettino Chimico Farmaceutico. Vol. 106, Pg. 595, 1967.