Chem Tetraethylthiuram Disulfide

Compound 8
  CheckMol                        TMF02:r0:m0
MF=C10H20N2S4 MW=296.52
 16 15  0  0  0               999 V2000
    0.0000   -0.0000   -0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118    1.5094   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3207    2.2641   -0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2735    2.2641   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6296    1.5330   -0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5589    1.5330   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2618    3.7735   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9386    2.2877   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8442    2.2877   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0472    4.5400   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9504    3.7971   -0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2475    1.5566   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2593    0.0708   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5564    2.3113   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9739   -0.6604   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8653    1.5801   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  2  0  0  0  0
  8 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
M  END

Tetraethylthiuram Disulfide

₹ 0.00 0.00

Chemical Name - Tetraethylthiuram Disulfide
Mol Weight - 296.547
Smiles - CCN(CC)C(SSC(N(CC)CC)=S)=S

Property Name	Property Value
Mol Name	Tetraethylthiuram Disulfide
Molweight	296.547
Monoisotopic Mass	296.050928
Clogp	3.343
Clogs	-3.266
H Acceptors	2
Total Surface Area	238.58
Relative Psa	0.4111
Polar Surface Area	121.26
Druglikeness	0.97088
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Shape Index	0.625
Molecular Flexibility	0.70735
Molecular Complexity	0.45401
Fragments	1
Non H Atoms	16
Non Ch Atoms	6
Electronegative Atoms	6
Rotatable Bonds	7
Sp3 Atoms	12
Symmetric Atoms	10
Smiles	CCN(CC)C(SSC(N(CC)CC)=S)=S
InChIKey	InChI=1S/C10H20N2S4/c1-5-11(6-2)9(13)15-16-10(14)12(7-3)8-4/h5-8H2,1-4H3
InChI	AUZONCFQVSMFAP-UHFFFAOYSA-N

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Tetraethylthiuram Disulfide