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Substance Name: IBD-78
RN: 10083-53-1
UNII: LVH0SCF4XH
InChIKey: RDBMZAMQBNYOIJ-VIZOYTHASA-N

Molecular Formula

  • C17-H19-N-S

Molecular Weight

  • 269.41
 
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Names and Synonyms

Name of Substance

  • IBD-78

Synonyms

  • 4-(3'-Methylaminopropylidene)-9,10-dihydro-4H-benzo(4,5)cyclohepta(1,2-b)thiophen
  • BRN 1347799
  • IBD 78
  • UNII-LVH0SCF4XH

Systematic Name

  • 4H-Benzo(4,5)cyclohepta(1,2-b)thiophene, 9,10-dihydro-4-(3-methylaminopropylidene)-

Registry Numbers

CAS Registry Number

  • 10083-53-1

FDA UNII

  • LVH0SCF4XH

System Generated Number

  • 0010083531

Structure Descriptors

InChI

1S/C17H19NS/c1-18-11-4-7-15-14-6-3-2-5-13(14)8-9-17-16(15)10-12-19-17/h2-3,5-7,10,12,18H,4,8-9,11H2,1H3/b15-7+

InChIKey

RDBMZAMQBNYOIJ-VIZOYTHASA-N

Smiles

C1(\c2c(scc2)CCc2c1cccc2)=C\CCNC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 34mg/kg (34mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 321, 1972.
mouse LD50 oral 420mg/kg (420mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 321, 1972.
rabbit LD50 intravenous 14mg/kg (14mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 321, 1972.
rabbit LD50 oral 2gm/kg (2000mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 321, 1972.
rat LD50 intravenous 28mg/kg (28mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 321, 1972.
rat LD50 oral 500mg/kg (500mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 321, 1972.