IUPAC name
S-[2-(ethylsulfonyl)ethyl] O,O-dimethyl phosphorothioate
SMILES
CCS(=O)(=O)CCSP(=O)(OC)OC
Compound class
Insecticide
Therapeutic area
Insecticide
Common name
demeton-S-methylsulphon
IUPAC name
S-[2-(ethylsulfonyl)ethyl] O,O-dimethyl phosphorothioate
SMILES
CCS(=O)(=O)CCSP(=O)(OC)OC
INCHI
InChI=1S/C6H15O5PS2/c1-4-14(8,9)6-5-13-12(7,10-2)11-3/h4-6H2,1-3H3
FORMULA
C6H15O5PS2
Common name
demeton-S-methylsulphon
IUPAC name
S-[2-(ethylsulfonyl)ethyl] O,O-dimethyl phosphorothioate
Molecular weight
262.284
clogP
-0.164
clogS
-1.794
HBond Acceptor
5
HBond Donor
0
Total Polar Surface Area
94.97
Number of Rings
0
Rotatable Bond
7
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00099 | ethanethiol |
|
CCS | 0.0165 |
| FDBF00283 | BLAH |
|
S(=O)O | 0.0244 |
| FDBF00317 | (dihydroxy-λ3-sulfanyl)methane |
|
C[S](O)O | 0.0141 |
| FDBF00322 | (dihydroxy-λ3-sulfanyl)ethane |
|
C(C)[S](O)O | 0.0055 |
| FDBF02019 | 1-methylsulfonylethane |
|
CS(=O)(=O)CC | 0.0017 |
| FDBF02021 | 1-ethylsulfonylethane |
|
CCS(=O)(=O)CC | 0.0007 |
| FDBF04617 | dimethyl hydrogen phosphite |
|
COP(O)OC | 0.0089 |
7 ,
1
