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Substance Name: Thiopyrano(2,3-b)indole, 2,3,4,9-tetrahydro-4-((cyclohexylamino)methyl)-, oxalate
RN: 73425-64-6
InChIKey: LDDNVAMOSFBEOG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H24-N2-S.C2-H2-O4

Molecular Weight

  • 390.5014
 
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Names and Synonyms

Synonyms

  • 4-((Cyclohexylamino)methyl)-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole oxalate
  • N-Cyclohexyl-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole-3-methylamine oxalate
  • Thiopyrano(2,3-b)indole-4-methylamine, 2,3,4,9-tetrahydro-N-cyclohexyl-, oxalate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 73425-64-6

System Generated Number

  • 0073425646

Molecular Formulas

Molecular Formula

  • C18-H24-N2-S.C2-H2-O4

Molecular Formula Fragments

  • C18-H24-N2-S
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H24N2S.C2H2O4/c1-20-16-10-6-5-9-14(16)17-15(11-12-21-18(17)20)19-13-7-3-2-4-8-13;3-1(4)2(5)6/h5-6,9-10,13,15,19H,2-4,7-8,11-12H2,1H3;(H,3,4)(H,5,6)

InChIKey

LDDNVAMOSFBEOG-UHFFFAOYSA-N

Smiles

Cn1c2ccccc2c3c1SCCC3NC4CCCCC4.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 400mg/kg (400mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 32, Pg. 877, 1984.