chempirical

Diethyldiphenylthiuram disulfide

C18H20N2S4CAS 41365-24-6392.61 g/mol

Open in Covalent MOL file
NSSSSN
Disulfide

Properties

Molecular formula
C18H20N2S4
Molar mass
392.61 g/mol
Exact mass
392.0509 Da
Melting point
83–84 °C (decomposes)
logP
5.99Crippen estimate
Polar surface area
6.5 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
4

Identifiers

CAS number
41365-24-6
SMILES
CCN(C(=S)SSC(=S)N(CC)c1ccccc1)c1ccccc1
InChIKey
DNCLGFHLBSMLPC-UHFFFAOYSA-N
InChI
InChI=1S/C18H20N2S4/c1-3-19(15-11-7-5-8-12-15)17(21)23-24-18(22)20(4-2)16-13-9-6-10-14-16/h5-14H,3-4H2,1-2H3

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Names and synonyms

5 names
  • Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), N,N′-diethyl-N,N′-diphenyl-
  • Disulfide, bis(ethylphenylthiocarbamoyl)
  • Formanilide, α,α′-dithiobis[N-ethylthio-
  • Ekagom TE
  • Thiuram EF

Work with Diethyldiphenylthiuram disulfide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Centralite85-98-356 % similar (T-4)-Bis(N-ethyl-N-phenylcarbamodithioato-κS,κS′)zinc14634-93-654 % similar Tetrabenzylthiuram disulfide10591-85-246 % similar Diethylaniline91-66-745 % similar Tetraethylthiuram disulfide97-77-845 % similar Ethylbenzylaniline92-59-139 % similar N-Ethyl-N-(2-chloroethyl)aniline92-49-938 % similar 2-(Ethylphenylamino)ethanol92-50-237 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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