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Substance Name: Indole, 1-benzyl-3-(1-methyl-2-pyrrolidinyl)-, mono(cyclohexanesulfamate)
RN: 20465-89-8
InChIKey: ISPVXYGNERQUGG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-N2.C6-H13-N-O3-S

Molecular Weight

  • 469.647
 
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Names and Synonyms

Synonym

  • 1-Benzyl-3-(1-methyl-2-pyrrolidinyl)indole cyclohexanesulfamate

Systematic Name

  • Indole, 1-benzyl-3-(1-methyl-2-pyrrolidinyl)-, mono(cyclohexanesulfamate)

Registry Numbers

CAS Registry Number

  • 20465-89-8

System Generated Number

  • 0020465898

Molecular Formulas

Molecular Formula

  • C20-H22-N2.C6-H13-N-O3-S

Molecular Formula Fragments

  • C20-H22-N2
  • C6-H13-N-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C20H22N2.C6H13NO3S/c1-21-13-7-12-19(21)18-15-22(14-16-8-3-2-4-9-16)20-11-6-5-10-17(18)20;8-11(9,10)7-6-4-2-1-3-5-6/h2-6,8-11,15,19H,7,12-14H2,1H3;6-7H,1-5H2,(H,8,9,10)

InChIKey

ISPVXYGNERQUGG-UHFFFAOYSA-N

Smiles

c1(c2c(n(c1)Cc1ccccc1)cccc2)[C@@H]1CCC[N@@H+]1C.C1(CCCCC1)NS(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 133mg/kg (133mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 415, 1964.
rat LD50 intraperitoneal 93mg/kg (93mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 415, 1964.