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Substance Name: PD 89454
RN: 71998-53-3
InChIKey: ZRJIHFGIUAHKOD-UHFFFAOYSA-N

Molecular Formula

  • C19-H26-N2-O3-S

Molecular Weight

  • 362.491
 
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Names and Synonyms

Name of Substance

  • PD 89454

Synonyms

  • 2-(2-(3-Azabicyclo(3.2.2)non-3-yl)ethyl)-5,6-dimethoxy-1,2-benzisothiazol-3(2H)-one
  • PD-89454

Systematic Name

  • 1,2-Benzisothiazol-3(2H)-one, 2-(2-(3-azabicyclo(3.2.2)non-3-yl)ethyl)-5,6-dimethoxy-

Registry Numbers

CAS Registry Number

  • 71998-53-3

System Generated Number

  • 0071998533

Structure Descriptors

InChI

1S/C19H26N2O3S/c1-23-16-9-15-18(10-17(16)24-2)25-21(19(15)22)8-7-20-11-13-3-4-14(12-20)6-5-13/h9-10,13-14H,3-8,11-12H2,1-2H3

InChIKey

ZRJIHFGIUAHKOD-UHFFFAOYSA-N

Smiles

c1c(c(cc2sn(c(c12)=O)CCN1CC2CCC(C1)CC2)OC)OC