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Substance Name: Thiopyrano(2,3-b)indole, 2,3,4,9-tetrahydro-9-benzoyl-4-((methylamino)methyl)-, oxalate
RN: 73426-19-4
InChIKey: AGYNFJYAPDODJX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H20-N2-O-S.C2-H2-O4

Molecular Weight

  • 426.4908
 
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Names and Synonyms

Synonyms

  • 9-Benzoyl-4-((methylamino)methyl)-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole oxalate
  • 9-Benzoyl-N-methyl-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole-4-methylamine oxalate
  • Thiopyrano(2,3-b)indole-4-methylamine, 2,3,4,9-tetrahydro-9-benzoyl-N-methyl-, oxalate

Systematic Name

  • Thiopyrano(2,3-b)indole, 2,3,4,9-tetrahydro-9-benzoyl-4-((methylamino)methyl)-, oxalate

Registry Numbers

CAS Registry Number

  • 73426-19-4

System Generated Number

  • 0073426194

Molecular Formulas

Molecular Formula

  • C20-H20-N2-O-S.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C20-H20-N2-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C20H20N2OS.C2H2O4/c1-21-13-15-11-12-24-20-18(15)16-9-5-6-10-17(16)22(20)19(23)14-7-3-2-4-8-14;3-1(4)2(5)6/h2-10,15,21H,11-13H2,1H3;(H,3,4)(H,5,6)

InChIKey

AGYNFJYAPDODJX-UHFFFAOYSA-N

Smiles

CNCC1CCSc2c1c3ccccc3n2C(=O)c4ccccc4.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 750mg/kg (750mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 32, Pg. 877, 1984.