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Substance Name: 2H-Thiopyranium, tetrahydro-4-(diphenylmethoxy)-1-methyl-, iodide
RN: 116197-05-8
InChIKey: SFOLQZNRGSQAAR-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-O-S.I

Molecular Weight

  • 426.3557
 
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Names and Synonyms

Synonyms

  • 4-(Benzhydryloxy)-1-methyltetrahydrothiopyranium iodide
  • 4-(Diphenylmethoxy)-1-methyl-2H-thiotetrahydropyranium iodide

Systematic Name

  • 2H-Thiopyranium, tetrahydro-4-(diphenylmethoxy)-1-methyl-, iodide

Registry Numbers

CAS Registry Number

  • 116197-05-8

System Generated Number

  • 0116197058

Molecular Formulas

Molecular Formula

  • C19-H23-O-S.I

Molecular Formula Fragments

  • C19-H23-O-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C19H23OS.HI/c1-21-14-12-18(13-15-21)20-19(16-8-4-2-5-9-16)17-10-6-3-7-11-17;/h2-11,18-19H,12-15H2,1H3;1H/q+1;/p-1

InChIKey

SFOLQZNRGSQAAR-UHFFFAOYSA-M

Smiles

C[S+]1CCC(CC1)OC(c2ccccc2)c3ccccc3.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 52, Pg. 2758, 1987.