IUPAC name
O,O-diethyl P-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)phosphonothioate
SMILES
CCOP(=S)(N1C(=O)c2ccccc2C1=O)OCC
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
ditalimfos
IUPAC name
O,O-diethyl P-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)phosphonothioate
SMILES
CCOP(=S)(N1C(=O)c2ccccc2C1=O)OCC
INCHI
InChI=1S/C12H14NO4PS/c1-3-16-18(19,17-4-2)13-11(14)9-7-5-6-8-10(9)12(13)15/h5-8H,3-4H2,1-2H3
FORMULA
C12H14NO4PS
Common name
ditalimfos
IUPAC name
O,O-diethyl P-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)phosphonothioate
Molecular weight
299.283
clogP
2.921
clogS
-2.733
HBond Acceptor
5
HBond Donor
0
Total Polar Surface Area
97.74
Number of Rings
2
Rotatable Bond
5
