N-[(2-nitrophenyl)carbamothioyl]benzamide

Base Information

Chemical Name:N-[(2-nitrophenyl)carbamothioyl]benzamide
CAS No.:66934-10-9
Molecular Formula:C14H11N3O3S
Molecular Weight:301.326
Hs Code.:
DSSTox Substance ID:DTXSID901333615
Nikkaji Number:J2.018.029C
ChEMBL ID:CHEMBL1525631

Synonyms:N-[(2-nitrophenyl)carbamothioyl]benzamide;66934-10-9;MLS000780126;SCHEMBL4251730;CHEMBL1525631;DTXSID901333615;HMS2794D15;STK644930;1-Benzoyl-3-(2-nitrophenyl)thiourea;n-benzoyl-n'-(2-nitrophenyl)thiourea;AKOS002263938;1-Benzoyl-3-(2-nitro-phenyl)-thiourea;SMR000420309;SR-01000207110;SR-01000207110-1

Suppliers and Price of N-[(2-nitrophenyl)carbamothioyl]benzamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of N-[(2-nitrophenyl)carbamothioyl]benzamide

Chemical Property:

XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:301.05211239
Heavy Atom Count:21
Complexity:405

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2[N+](=O)[O-]

Technology Process of N-[(2-nitrophenyl)carbamothioyl]benzamide

There total 7 articles about N-[(2-nitrophenyl)carbamothioyl]benzamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 88.0%

: 88-74-4
2-nitro-aniline

: 532-55-8
Benzoyl isothiocyanate

: 66934-10-9
N-[[(2-nitrophenyl)amino]thioxomethyl]-benzamide

Guidance literature:: In diethyl ether; for 0.5h; Ambient temperature;
DOI:10.1002/jhet.5570220134

Reference yield:

: 98-88-4
benzoyl chloride

: 88-74-4
2-nitro-aniline

: 66934-10-9
N-[[(2-nitrophenyl)amino]thioxomethyl]-benzamide

Guidance literature:: benzoyl chloride; With ammonium thiocyanate; In acetone; at 20 ℃; for 2h;

2-nitro-aniline; In acetone; at 20 ℃; for 12h;
DOI:10.1016/j.bioorg.2020.104271

Reference yield:

: 98-88-4
benzoyl chloride

: 66934-10-9
N-[[(2-nitrophenyl)amino]thioxomethyl]-benzamide

Guidance literature:: Multi-step reaction with 2 steps

1: acetone / 0.25 h / Reflux

2: acetone / 0.5 h / Reflux

In acetone;
DOI:10.1039/c5ra07886e