1-Benzoyl-3-phenyl-2-thiourea N-(苯基氨基甲硫酰基)苯甲酰胺

CAS 4921-82-8 MFCD00022118

化学结构图

4921-82-8
SMILES: O=C(NC(=S)Nc1ccccc1)c1ccccc1

化学属性

Mol. FormulaC14H12N2OS
Mol. Weight256.32
Melting Point159 °C

别名和识别编码

Chemical NameN-(Phenylcarbamothioyl)Benzamide
CAS Number4921-82-8
Alfabeta NameBENZOYLPHENYLTHIOUREA 132-----
MDL NumberMFCD00022118
Synonym N-(phenylcarbamothioyl)benzamide {LY} N-(phenylcarbamothioyl)benzamide N-(phenylcarbothiol)benzamide TM-2-51 {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {} {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {} {} {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-(phenylcarbamothioyl)benzamide {} {} {} {} {} {} {} {} {} {} {} {} {}
Chemical Name TranslationN-(苯基氨基甲硫酰基)苯甲酰胺
InChIKeyGVHZQIIMGRLFMX-UHFFFAOYSA-N
Wiswesser Line NotationSUYMR&MVR
LabNetwork Molecule IDLN00159143
PubChem Substance ID728148
InChIInChI=1S/C14H12N2OS/c17-13(11-7-3-1-4-8-11)16-14(18)15-12-9-5-2-6-10-12/h1-10H,(H2,15,16,17,18)
Canonical SMILESS=C(NC1=CC=CC=C1)NC(C2=CC=CC=C2)=O
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; amide; 1fragment

相关文献及参考

  • Short: III/35C1 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 1: Aliphatic and Aromatic Hydrocarbons, Steroids, Carbohydrates Author: Gupta, R.R.; Jain, M. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C1 Year: 2000 ISBN: 3-540-66780-6 ISBN: 978-3-540-66780-3 Internet Resource: DOI:10.1007/b60149 RefComment: VII, 310 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.

安全信息

Warnings IRRITANT
RTECSYS1400000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 50 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD277-689

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 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#03316

Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P301+P317
  • P330 Rinse mouth. 漱口
  • P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • MOL 文件:4921-82-8.mol
  • Sigma Aldrich:4921-82-8(sigmaaldrich)

系列性分类

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