(3Z)-3-(1,1-Dioxo-2-phenyl-1,4,2-dithiazolidin-3-ylidene)-1,1-diphenylthiourea

Base Information

Chemical Name:(3Z)-3-(1,1-Dioxo-2-phenyl-1,4,2-dithiazolidin-3-ylidene)-1,1-diphenylthiourea
CAS No.:64803-10-7
Molecular Formula:C₂₁H₁₇N₃O₂S₃
Molecular Weight:439.583
Hs Code.:
NSC Number:298213
DSSTox Substance ID:DTXSID70429724
ChEMBL ID:CHEMBL485888

Synonyms:64803-10-7;NSC298213;(3Z)-3-(1,1-Dioxo-2-phenyl-1,4,2-dithiazolidin-3-ylidene)-1,1-diphenylthiourea;TYT-1;CHEMBL485888;SCHEMBL12147083;DTXSID70429724;WHFLLSDSNHZKAX-DQRAZIAOSA-N;AKOS040747559;NSC-298213

Suppliers and Price of (3Z)-3-(1,1-Dioxo-2-phenyl-1,4,2-dithiazolidin-3-ylidene)-1,1-diphenylthiourea

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 7 raw suppliers

Chemical Property of (3Z)-3-(1,1-Dioxo-2-phenyl-1,4,2-dithiazolidin-3-ylidene)-1,1-diphenylthiourea

Chemical Property:

Vapor Pressure:7.39E-14mmHg at 25°C
Boiling Point:589.1°Cat760mmHg
Flash Point:310.1°C
Density:1.34g/cm³
XLogP3:5.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:439.04829031
Heavy Atom Count:29
Complexity:683

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1SC(=NC(=S)N(C2=CC=CC=C2)C3=CC=CC=C3)N(S1(=O)=O)C4=CC=CC=C4
Isomeric SMILES:C1S/C(=N\C(=S)N(C2=CC=CC=C2)C3=CC=CC=C3)/N(S1(=O)=O)C4=CC=CC=C4

Technology Process of (3Z)-3-(1,1-Dioxo-2-phenyl-1,4,2-dithiazolidin-3-ylidene)-1,1-diphenylthiourea

There total 2 articles about (3Z)-3-(1,1-Dioxo-2-phenyl-1,4,2-dithiazolidin-3-ylidene)-1,1-diphenylthiourea 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: 31.0%

: 3898-08-6
1,1-diphenylthiourea

: 103-72-0
phenyl isothiocyanate

: 124-63-0
methanesulfonyl chloride

: 64803-10-7
(1,1-dioxo-2-phenyl-1λ⁶-[1,4,2]dithiazolidin-3-ylidene)-diphenyl-thiourea

Guidance literature:: 1,1-diphenylthiourea; phenyl isothiocyanate; With sodium hydride; In tetrahydrofuran; paraffin oil; at 45 ℃; Inert atmosphere;

With hydrogen bromide; dihydrogen peroxide; In tetrahydrofuran; paraffin oil; Inert atmosphere;

methanesulfonyl chloride; Further stages;
DOI:10.1055/s-0031-1290124