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Substance Name: 2-Benzimidazolinone, 1-(1-(3-phenylthiopropyl)-1,2,3,6-tetrahydro-4-pyridyl)-
RN: 100447-45-8
InChIKey: SPOUJVRGQYCWKG-UHFFFAOYSA-N

Molecular Formula

  • C21-H23-N3-O-S

Molecular Weight

  • 365.4987
 
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Names and Synonyms

Synonym

  • 1-(1-(3-Phenylthiopropyl)-1,2,3,6-tetrahydro-4-pyridyl)-2-benzimidazolinone

Systematic Name

  • 2-Benzimidazolinone, 1-(1-(3-phenylthiopropyl)-1,2,3,6-tetrahydro-4-pyridyl)-

Registry Numbers

CAS Registry Number

  • 100447-45-8

System Generated Number

  • 0100447458

Structure Descriptors

InChI

1S/C21H23N3OS/c25-21-22-19-9-4-5-10-20(19)24(21)17-11-14-23(15-12-17)13-6-16-26-18-7-2-1-3-8-18/h1-5,7-11H,6,12-16H2,(H,22,25)

InChIKey

SPOUJVRGQYCWKG-UHFFFAOYSA-N

Smiles

c1ccc(cc1)SCCCN2CCC(=CC2)n3c4ccccc4[nH]c3=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 8910ug/kg (8.91mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#11317,