IUPAC name
O,O-dimethyl S-[2-[(1-methylethyl)thio]ethyl] phosphorodithioate
SMILES
CC(C)SCCSP(=S)(OC)OC
Compound class
Insecticide
Therapeutic area
Insecticide
Common name
isothioate
IUPAC name
O,O-dimethyl S-[2-[(1-methylethyl)thio]ethyl] phosphorodithioate
SMILES
CC(C)SCCSP(=S)(OC)OC
INCHI
InChI=1S/C7H17O2PS3/c1-7(2)12-5-6-13-10(11,8-3)9-4/h7H,5-6H2,1-4H3
FORMULA
C7H17O2PS3
Common name
isothioate
IUPAC name
O,O-dimethyl S-[2-[(1-methylethyl)thio]ethyl] phosphorodithioate
Molecular weight
260.377
clogP
3.280
clogS
-2.214
HBond Acceptor
3
HBond Donor
0
Total Polar Surface Area
110.96
Number of Rings
0
Rotatable Bond
7
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00007 | propane |
|
C(C)C | 0.2412 |
| FDBF00099 | ethanethiol |
|
CCS | 0.0165 |
| FDBF01460 | propane-2-thiol |
|
C(C)(C)S | 0.0027 |
| FDBF01768 | methoxyphosphinothious acid |
|
O(C)PS | 0.0155 |
| FDBF04561 | 2-methylsulfanylpropane |
|
S(C)C(C)C | 0.0007 |
| FDBF05172 | 2-ethylsulfanylpropane |
|
CC(C)SCC | 0.0014 |
6 ,
1
