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Substance Name: 2-Benzimidazolinone, 1-(1-(3-phenylsulfonylpropyl)-4-piperidyl)-
RN: 100447-44-7
InChIKey: MCDSSYMWAOLDCH-UHFFFAOYSA-N

Molecular Formula

  • C21-H25-N3-O3-S

Molecular Weight

  • 399.5125
 
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Names and Synonyms

Synonym

  • 1-1-(3-Phenylsulfonylpropyl)-4-piperidyl-2-benzimidazolinone

Systematic Name

  • 2-Benzimidazolinone, 1-(1-(3-phenylsulfonylpropyl)-4-piperidyl)-

Registry Numbers

CAS Registry Number

  • 100447-44-7

System Generated Number

  • 0100447447

Structure Descriptors

InChI

1S/C21H25N3O3S/c25-21-22-19-9-4-5-10-20(19)24(21)17-11-14-23(15-12-17)13-6-16-28(26,27)18-7-2-1-3-8-18/h1-5,7-10,17H,6,11-16H2,(H,22,25)

InChIKey

MCDSSYMWAOLDCH-UHFFFAOYSA-N

Smiles

O=C1Nc2ccccc2N1C3CCN(CCCS(=O)(=O)c4ccccc4)CC3

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#11369,