IUPAC name
N′-(3-chloro-4-ethoxyphenyl)-N,N-dimethylurea
SMILES
CCOc1ccc(cc1Cl)NC(=O)N(C)C
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
chloreturon
IUPAC name
N′-(3-chloro-4-ethoxyphenyl)-N,N-dimethylurea
SMILES
CCOc1ccc(cc1Cl)NC(=O)N(C)C
INCHI
InChI=1S/C11H15ClN2O2/c1-4-16-10-6-5-8(7-9(10)12)13-11(15)14(2)3/h5-7H,4H2,1-3H3,(H,13,15)
FORMULA
C11H15ClN2O2
Common name
chloreturon
IUPAC name
N′-(3-chloro-4-ethoxyphenyl)-N,N-dimethylurea
Molecular weight
242.702
clogP
2.042
clogS
-2.728
HBond Acceptor
4
HBond Donor
1
Total Polar Surface Area
45.06
Number of Rings
1
Rotatable Bond
4
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00041 | ethanol |
|
CCO | 0.1474 |
| FDBF00066 | N-methylmethanamine |
|
N(C)C | 0.0914 |
| FDBF02713 | N-(4-hydroxyphenyl)formamide |
|
Oc1ccc(cc1)NC=O | 0.0031 |
| FDBF05444 | (1Z)-N-(3-chloro-4-hydroxyphenyl)methanimidic acid |
|
Oc1c(cc(cc1)NC=O)Cl | 0.0010 |
| FDBF05867 | 3-(3-chlorophenyl)-1,1-dimethylurea |
|
N(C)(C)C(=O)Nc1cc(ccc1)Cl | 0.0014 |
| FDBF05868 | (1Z)-N-(3-chloro-4-ethoxyphenyl)methanimidic acid |
|
c1(c(cc(cc1)NC=O)Cl)OCC | 0.0014 |
| FDBF05869 | 3-(3-chloro-4-hydroxyphenyl)-1,1-dimethylurea |
|
N(C)(C)C(=O)Nc1cc(c(cc1)O)Cl | 0.0003 |
| FDBF06956 | (1Z)-N-(4-ethoxyphenyl)methanimidic acid |
|
c1(ccc(cc1)NC=O)OCC | 0.0010 |
8 ,
1
