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Substance Name: 1,3,8-Triazaspiro(4.5)decan-4-one, 1-phenyl-8-(3-(phenylthio)propyl)-
RN: 7139-26-6
InChIKey: BLOQBDJJVIGGNX-UHFFFAOYSA-N

Molecular Formula

  • C22-H27-N3-O-S

Molecular Weight

  • 381.541
 
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Names and Synonyms

Synonyms

  • 1-Phenyl-8-(3-phenylthiopropyl)-1,3,8-triazaspiro(4.5)decan-4-one
  • 5-26-04-00106 (Beilstein Handbook Reference)
  • BRN 0630465

Systematic Name

  • 1,3,8-Triazaspiro(4.5)decan-4-one, 1-phenyl-8-(3-(phenylthio)propyl)-

Registry Numbers

CAS Registry Number

  • 7139-26-6

System Generated Number

  • 0007139266

Structure Descriptors

InChI

1S/C22H27N3OS/c26-21-22(25(18-23-21)19-8-3-1-4-9-19)12-15-24(16-13-22)14-7-17-27-20-10-5-2-6-11-20/h1-6,8-11H,7,12-18H2,(H,23,26)

InChIKey

BLOQBDJJVIGGNX-UHFFFAOYSA-N

Smiles

N1(CNC(C21CCN(CC2)CCCSc1ccccc1)=O)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 10mg/kg (10mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#11375,