IUPAC name
4-iodo-2-[[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]amino]sulfonyl]benzoic acid
SMILES
Cc1[nH]/c(=NC(=O)NS(=O)(=O)c2cc(ccc2C(=O)O)I)/nc(n1)OC
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
iodosulfuron
IUPAC name
4-iodo-2-[[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]amino]sulfonyl]benzoic acid
SMILES
Cc1[nH]/c(=NC(=O)NS(=O)(=O)c2cc(ccc2C(=O)O)I)/nc(n1)OC
INCHI
InChI=1S/C13H12IN5O6S/c1-6-15-11(18-13(16-6)25-2)17-12(22)19-26(23,24)9-5-7(14)3-4-8(9)10(20)21/h3-5H,1-2H3,(H,20,21)(H2,15,16,17,18,19,22)
FORMULA
C13H12IN5O6S
Common name
iodosulfuron
IUPAC name
4-iodo-2-[[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]amino]sulfonyl]benzoic acid
Molecular weight
493.234
clogP
1.636
clogS
-3.507
HBond Acceptor
9
HBond Donor
3
Total Polar Surface Area
167.19
Number of Rings
2
Rotatable Bond
5
