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Substance Name: 1,3-Dithiolane-4-methanol, 2-methyl-2-(4-(1-methylethyl)phenyl)-, carbamate
RN: 35801-67-3
InChIKey: CXTZVUUTBSIQMU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H21-N-O2-S2

Molecular Weight

  • 311.468
 
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Names and Synonyms

Synonyms

  • 2-Methyl-2-(4-(1-methylethyl)phenyl)-1,3-dithiolane-4-methanol carbamate
  • 5-19-02-00586 (Beilstein Handbook Reference)
  • BRN 1259408

Systematic Name

  • 1,3-Dithiolane-4-methanol, 2-methyl-2-(4-(1-methylethyl)phenyl)-, carbamate

Registry Numbers

CAS Registry Number

  • 35801-67-3

System Generated Number

  • 0035801673

Structure Descriptors

InChI

1S/C15H21NO2S2/c1-10(2)11-4-6-12(7-5-11)15(3)19-9-13(20-15)8-18-14(16)17/h4-7,10,13H,8-9H2,1-3H3,(H2,16,17)

InChIKey

CXTZVUUTBSIQMU-UHFFFAOYSA-N

Smiles

S1[C@@](S[C@@H](C1)COC(N)=O)(c1ccc(cc1)C(C)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Pharmazie. Vol. 31, Pg. 317, 1976.
mouse LD50 oral > 1gm/kg (1000mg/kg)   Pharmazie. Vol. 31, Pg. 317, 1976.