Indole, 3-(3-amino-2-butyl)-5-benzylthio-

CAS 5102-10-3 MFCD N/A

化学结构图

5102-10-3
SMILES: CC(N)C(C)c1c[nH]c2ccc(SCc3ccccc3)cc12

化学属性

Mol. FormulaC19H22N2S
Mol. Weight310.49

别名和识别编码

Synonym 3-(2'-Aminobutyl-3')-5-benzylthioindole
Wiswesser Line NotationT56 BMJ DY1&YZ1 GS1R
Chemical NameIndole, 3-(3-amino-2-butyl)-5-benzylthio-
CAS Number5102-10-3
Beilstein Registry Number0422263
InChIKeyQTPKJXSZCGWIIV-UHFFFAOYSA-N
PubChem Substance ID21179
InChIInChI=1S/C19H22N2S/c1-13(14(2)20)18-11-21-19-9-8-16(10-17(18)19)22-12-15-6-4-3-5-7-15/h3-11,13-14,21H,12,20H2,1-2H3
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安全信息

RTECSNL3790000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 35 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#12407

系列性分类

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