IUPAC name
bis(1-methylethyl) 2-(1,3-dithiolan-2-ylidene)propanedioate
SMILES
CC(C)OC(=O)C(=C1SCCS1)C(=O)OC(C)C
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
isoprothiolane
IUPAC name
bis(1-methylethyl) 2-(1,3-dithiolan-2-ylidene)propanedioate
SMILES
CC(C)OC(=O)C(=C1SCCS1)C(=O)OC(C)C
INCHI
InChI=1S/C12H18O4S2/c1-7(2)15-10(13)9(11(14)16-8(3)4)12-17-5-6-18-12/h7-8H,5-6H2,1-4H3
FORMULA
C12H18O4S2
Common name
isoprothiolane
IUPAC name
bis(1-methylethyl) 2-(1,3-dithiolan-2-ylidene)propanedioate
Molecular weight
290.399
clogP
2.746
clogS
-1.980
HBond Acceptor
4
HBond Donor
0
Total Polar Surface Area
103.2
Number of Rings
1
Rotatable Bond
6
