IUPAC name
2-[[2-chloro-4-fluoro-5-[(tetrahydro-3-oxo-1H,3H-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]thio]acetic acid
SMILES
C1CCn2c(=O)sc(=Nc3cc(c(cc3F)Cl)SCC(=O)O)n2C1
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
fluthiacet
IUPAC name
2-[[2-chloro-4-fluoro-5-[(tetrahydro-3-oxo-1H,3H-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]thio]acetic acid
SMILES
C1CCn2c(=O)sc(=Nc3cc(c(cc3F)Cl)SCC(=O)O)n2C1
INCHI
InChI=1S/C14H13ClFN3O3S2/c15-8-5-9(16)10(6-11(8)23-7-12(20)21)17-13-18-3-1-2-4-19(18)14(22)24-13/h5-6H,1-4,7H2,(H,20,21)
FORMULA
C14H13ClFN3O3S2
Common name
fluthiacet
IUPAC name
2-[[2-chloro-4-fluoro-5-[(tetrahydro-3-oxo-1H,3H-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]thio]acetic acid
Molecular weight
389.853
clogP
3.736
clogS
-3.269
HBond Acceptor
4
HBond Donor
1
Total Polar Surface Area
130.13
Number of Rings
3
Rotatable Bond
4
