IUPAC name
2-(2-chloroethoxy)-N-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]benzenesulfonamide
SMILES
Cc1[nH]/c(=NC(=O)NS(=O)(=O)c2ccccc2OCCCl)/nc(n1)OC
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
triasulfuron
IUPAC name
2-(2-chloroethoxy)-N-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]benzenesulfonamide
SMILES
Cc1[nH]/c(=NC(=O)NS(=O)(=O)c2ccccc2OCCCl)/nc(n1)OC
INCHI
InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)
FORMULA
C14H16ClN5O5S
Common name
triasulfuron
IUPAC name
2-(2-chloroethoxy)-N-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]benzenesulfonamide
Molecular weight
401.825
clogP
2.132
clogS
-4.289
HBond Acceptor
8
HBond Donor
2
Total Polar Surface Area
139.12
Number of Rings
2
Rotatable Bond
7
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00005 | benzene |
|
c1ccccc1 | 0.2824 |
| FDBF00006 | phenol |
|
c1ccc(cc1)O | 0.0897 |
| FDBF00211 | anisole |
|
COc1ccccc1 | 0.0423 |
| FDBF00279 | (dihydroxy-λ3-sulfanyl)benzene |
|
[S](O)(O)c1ccccc1 | 0.0052 |
| FDBF00283 | BLAH |
|
S(=O)O | 0.0244 |
| FDBF00547 | chloroethane |
|
ClCC | 0.0076 |
| FDBF04779 | 2-chloroethanol |
|
C(Cl)CO | 0.0010 |
| FDBF04783 | 2-chloroethoxybenzene |
|
C(Cl)COc1ccccc1 | 0.0007 |
| FDBF06635 | 1-(dihydroxy-λ3-sulfanyl)-2-methoxybenzene |
|
COc1c([S](O)O)cccc1 | 0.0003 |
9 ,
1
