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Substance Name: 8-Azaspiro(4.5)decane-7,9-dione, 8-(3-((3,4-dihydro-2H-1-benzothiopyran-8-yl)oxy)-2-hydroxypropyl)-
RN: 153804-33-2
InChIKey: METDFQQFARFYCX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N-O4-S

Molecular Weight

  • 389.5133
 
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Names and Synonyms

Synonym

  • 8-((3-(7,9-Dioxo-8-azaspiro(4.5)decan-8-yl)-2-hydroxypropyl)oxy)thiochroman

Systematic Name

  • 8-Azaspiro(4.5)decane-7,9-dione, 8-(3-((3,4-dihydro-2H-1-benzothiopyran-8-yl)oxy)-2-hydroxypropyl)-

Registry Numbers

CAS Registry Number

  • 153804-33-2

System Generated Number

  • 0153804332

Structure Descriptors

InChI

1S/C21H27NO4S/c23-16(14-26-17-7-3-5-15-6-4-10-27-20(15)17)13-22-18(24)11-21(12-19(22)25)8-1-2-9-21/h3,5,7,16,23H,1-2,4,6,8-14H2

InChIKey

METDFQQFARFYCX-UHFFFAOYSA-N

Smiles

c1cc2c(c(c1)OCC(CN3C(=O)CC4(CCCC4)CC3=O)O)SCCC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #5389668,