Thiourea, N-ethyl-N'-phenyl-N-[2-[[(phenylamino)thioxomethyl]amino]ethyl]-

Base Information

• Chemical Name: Thiourea, N-ethyl-N'-phenyl-N-[2-[[(phenylamino)thioxomethyl]amino]ethyl]-
• CAS No.: 147381-67-7
• Molecular Formula: C₁₈H₂₂N₄S₂
• Molecular Weight: 358.531
• DSSTox Substance ID: DTXSID901145026
• Mol file: 147381-67-7.mol

Synonyms:DTXSID901145026;AKOS024383969;Thiourea, N-ethyl-N'-phenyl-N-[2-[[(phenylamino)thioxomethyl]amino]ethyl]-;147381-67-7

Chemical Property of Thiourea, N-ethyl-N'-phenyl-N-[2-[[(phenylamino)thioxomethyl]amino]ethyl]-

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 358.12858907
• Heavy Atom Count: 24
• Complexity: 391

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCN(CCNC(=S)NC1=CC=CC=C1)C(=S)NC2=CC=CC=C2

Technology Process of Thiourea, N-ethyl-N'-phenyl-N-[2-[[(phenylamino)thioxomethyl]amino]ethyl]-

There total 1 articles about Thiourea, N-ethyl-N'-phenyl-N-[2-[[(phenylamino)thioxomethyl]amino]ethyl]- 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: 80.0%

N-ethylethane-1,2-diamine (110-72-5) + phenyl isothiocyanate (103-72-0) → C6H5NHC(S)N(C2H5)(CH2)2NHC(S)NHC6H5 (147381-67-7)

Guidance literature:

In ethanol; for 0.25h; Heating;

DOI:10.1016/0022-328X(93)83022-N

Reference yield: 70.0%

potassium tetrachloropalladate(II) (10025-98-6) + C6H5NHC(S)N(C2H5)(CH2)2NHC(S)NHC6H5 (147381-67-7) → Pd(2+)*C6H5NHCSN(CH2CH3)C2H4NHCSNHC6H5*2Cl(1-)={Pd(C6H5NHCSN(C2H5)C2H4NHCSNHC6H5)Cl2}

Guidance literature:

In ethanol; water; room temp.; filtn., washed, dried (vac.), elem. anal.;

DOI:10.1016/0022-328X(93)83022-N

Reference yield: 55.0%

C6H5NHC(S)N(C2H5)(CH2)2NHC(S)NHC6H5 (147381-67-7) + copper dichloride → Cu(1+)*C6H5NHCSN(C2H5)CH2CH2NHCSNHC6H5*Cl(1-)=CuCl(C6H5NHCSN(C2H5)C2H4NHCSNHC6H5) (157595-43-2) + {CuCl2{(C7H4NS)N(CH2)2N(C2H5)CNC6H5}} (148052-62-4)

Guidance literature:

In ethanol; under N2; an ethanolic soln. of CuCl2 was added to a soln. of the organ. compd. in ethanol at room temp.; filtered, washed with ethanol and ether, dried in vac.; elem. anal.;

DOI:10.1016/0020-1693(94)03973-9

upstream raw materials:

N-ethylethane-1,2-diamine

phenyl isothiocyanate

Downstream raw materials:

Cu⁽¹⁺⁾*C₆H₅NHCSN(C₂H₅)CH₂CH₂NHCSNHC₆H₅*Cl^(1-)=CuCl(C₆H₅NHCSN(C₂H₅)C₂H₄NHCSNHC₆H₅)

{CuCl₂{(C₇H₄NS)N(CH₂)2N(C₂H₅)CNC₆H₅}}