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Substance Name: 2H-1-Benzopyran-3-amine, 3,4-dihydro-N-(4-((3,4-dihydro-2H-1-benzothiopyran-8-yl)oxy)butyl)-5-methoxy-
RN: 153804-57-0
InChIKey: PACAWKKVNLIRTM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H29-N-O3-S

Molecular Weight

  • 399.5521
 
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Names and Synonyms

Synonym

  • 8-((4-((5-Methoxydihydro-(2H)-benzo(b)pyran-3-yl)amino)butyl)oxy)thiochroman

Systematic Name

  • 2H-1-Benzopyran-3-amine, 3,4-dihydro-N-(4-((3,4-dihydro-2H-1-benzothiopyran-8-yl)oxy)butyl)-5-methoxy-

Registry Numbers

CAS Registry Number

  • 153804-57-0

System Generated Number

  • 0153804570

Structure Descriptors

InChI

1S/C23H29NO3S/c1-25-20-9-5-10-21-19(20)15-18(16-27-21)24-12-2-3-13-26-22-11-4-7-17-8-6-14-28-23(17)22/h4-5,7,9-11,18,24H,2-3,6,8,12-16H2,1H3

InChIKey

PACAWKKVNLIRTM-UHFFFAOYSA-N

Smiles

COc1cccc2c1CC(CO2)NCCCCOc3cccc4c3SCCC4

Toxicity

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