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N-{[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl}-3-nitrobenzamide is a complex organic compound with the molecular formula C9H8N6O4S. It is characterized by the presence of a 3-nitrobenzamide group, which is an amide derivative of 3-nitrobenzoic acid, and a 5-amino-1H-1,2,4-triazol-3-yl sulfanyl group, which is a sulfur-containing heterocyclic ring with an amino group. N-{[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl}-3-nitrobenzamide is known for its potential applications in pharmaceuticals and chemical research, particularly in the development of new drugs and the study of chemical reactions involving sulfur and nitrogen-containing moieties. Its structure provides a unique combination of functional groups that can participate in various chemical interactions, making it a subject of interest for synthetic chemists and medicinal chemists alike.

5553-61-7

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5553-61-7 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 5553-61-7 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,5,5 and 3 respectively; the second part has 2 digits, 6 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 5553-61:
(6*5)+(5*5)+(4*5)+(3*3)+(2*6)+(1*1)=97
97 % 10 = 7
So 5553-61-7 is a valid CAS Registry Number.

5553-61-7SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name N-[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-3-nitrobenzamide

1.2 Other means of identification

Product number -
Other names N-{[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl}-3-nitrobenzamide

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:5553-61-7 SDS

5553-61-7Downstream Products

5553-61-7Relevant academic research and scientific papers

Synthesis, antitumor evaluation and crystal structure of hydroxyurea derivatives

Mai, Xi,Lu, Xiaosan,Xia, Hongying,Cao, Yusheng,Liao, Yijing,Lv, Xiaolan

experimental part, p. 94 - 97 (2010/04/26)

A series of hydroxyurea derivatives have been synthesized and elucidated by means of FT-IR, 1H-, 13C-NMR and MS. The exact stereostructures of representative compounds have been determined by X-ray crystal structure analysis. In the crystals, inversion dimers linked by pairs of N-H...O hydrogen bonds occurred, and further N-H...O links led to chains of molecules. In vitro antitumor activities against Tca8113 human tongue cancer cells and L1210 murine leukemia cells were evaluated. A total of 8 of the 12 compounds had higher inhibitory activities than hydroxyurea against L1210 cells. Among them, the most promising compounds were 3e, 3d, 3a and 2d.

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