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Substance Name: Butyric acid, 4-(benzoyl((cyclopentyl(4,5-dihydro-1H-imidazol-2-yl)amino)methyl)amino)-
RN: 81186-21-2
InChIKey: NIPSVSOVTLKTPQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H28-N4-O3

Molecular Weight

  • 372.466
 
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Names and Synonyms

Synonym

  • 4-(Benzoyl((cyclopentyl(4,5-dihydro-1H-imidazol-2-yl)amino)methyl)amino)butyric acid

Systematic Name

  • Butyric acid, 4-(benzoyl((cyclopentyl(4,5-dihydro-1H-imidazol-2-yl)amino)methyl)amino)-

Registry Numbers

CAS Registry Number

  • 81186-21-2

System Generated Number

  • 0081186212

Structure Descriptors

InChI

1S/C20H28N4O3/c25-18(26)11-6-14-23(19(27)16-7-2-1-3-8-16)15-24(17-9-4-5-10-17)20-21-12-13-22-20/h1-3,7-8,17H,4-6,9-15H2,(H,21,22)(H,25,26)

InChIKey

NIPSVSOVTLKTPQ-UHFFFAOYSA-N

Smiles

N(C1CCCC1)(C=1NCCN1)CN(C(c1ccccc1)=O)CCCC(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 383mg/kg (383mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: ATAXIA
Acta Pharmaceutica Jugoslavica. Vol. 31, Pg. 229, 1981.