4-(Dimethylamino)benzaldehyde thiosemicarbazone 2-(4-(二甲氨基)苄亚基)肼-1-碳硫酰胺

CAS 2929-81-9 MFCD00276108

化学结构图

2929-81-9
SMILES: CN(C)c1ccc(C=NNC(N)=S)cc1

化学属性

Mol. FormulaC10H14N4S
Mol. Weight222.31

别名和识别编码

Chemical Name4-(Dimethylamino)benzaldehyde thiosemicarbazone
Alfabeta NameDIMETHYLAMINOPHENYLMETHYLENEHYDRAZINECARBOTHIOAMIDE 241[]()----{}
MDL NumberMFCD00276108
CAS Number2929-81-9
Chemical Name Translation2-(4-(二甲氨基)苄亚基)肼-1-碳硫酰胺
InChIKeyMUDHKEQEBJQRRG-GHXNOFRVSA-N
Wiswesser Line NotationSUYZMNU1R DN1&1
Synonym 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {} {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {} {} {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {} {} {} {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {} {} {} {} {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {} {} {} {} {} {} {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-(Dimethylamino)benzylidene)hydrazine-1-carbothioamide {} {} {} {} {} {} {} {} {}
PubChem Substance ID6436743
InChIInChI=1S/C10H14N4S/c1-14(2)9-5-3-8(4-6-9)7-12-13-10(11)15/h3-7H,1-2H3,(H3,11,13,15)/b12-7+
Canonical SMILESCN(C1=CC=C(C=C1)C=NNC(N)=S)C
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分类

  • {KO} Thioamides

安全信息

Warnings IRRITANT
RTECSCU5952000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique.
   (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France)
   V.9-    1974-  Volume(issue)/page/year: 15,33,1980

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >250 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NCNSA6 National Academy of Sciences, National Research Council,
   Chemical-Biological Coordination Center, Review.  (Washington, DC)
   Volume(issue)/page/year: 5,12,1953

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Parenteral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 800 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CBCCT* "Summary Tables of Biological Tests," National Research Council
   Chemical-Biological Coordination Center.  (National Academy of Science
   Library, 2101 Constitution Ave., NW, Washington, DC 20418)
   Volume(issue)/page/year: 7,686,1955

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CBCCT* "Summary Tables of Biological Tests," National Research Council
   Chemical-Biological Coordination Center.  (National Academy of Science
   Library, 2101 Constitution Ave., NW, Washington, DC 20418)
   Volume(issue)/p

Storage condition

药物吸收、分布、代谢与排泄(ADME)

H-bond Donors
2
H-bond Acceptors
2
Rotatable Bonds
5

系列性分类

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