IUPAC name
4-chloro-N-(cyanoethoxymethyl)benzamide
SMILES
CCOC(C#N)NC(=O)c1ccc(cc1)Cl
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
zarilamid
IUPAC name
4-chloro-N-(cyanoethoxymethyl)benzamide
SMILES
CCOC(C#N)NC(=O)c1ccc(cc1)Cl
INCHI
InChI=1S/C11H11ClN2O2/c1-2-16-10(7-13)14-11(15)8-3-5-9(12)6-4-8/h3-6,10H,2H2,1H3,(H,14,15)
FORMULA
C11H11ClN2O2
Common name
zarilamid
IUPAC name
4-chloro-N-(cyanoethoxymethyl)benzamide
Molecular weight
238.670
clogP
2.005
clogS
-3.082
HBond Acceptor
3
HBond Donor
1
Total Polar Surface Area
62.12
Number of Rings
1
Rotatable Bond
5
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00003 | formamide |
|
C(=O)N | 0.1240 |
| FDBF00016 | chlorobenzene |
|
c1ccc(cc1)Cl | 0.0718 |
| FDBF00041 | ethanol |
|
CCO | 0.1474 |
| FDBF00569 | acetonitrile |
|
CC#N | 0.0161 |
| FDBF01839 | 4-chlorobenzamide |
|
O=C(N)c1ccc(cc1)Cl | 0.0017 |
| FDBF07652 | 2-hydroxyacetonitrile |
|
OCC#N | 0.0003 |
| FDBF07653 | N-(cyanomethyl)formamide |
|
N(C=O)CC#N | 0.0003 |
| FDBF07655 | 2-ethoxyacetonitrile |
|
O(CC)CC#N | 0.0003 |
| FDBF07656 | 4-chloro-N-(cyanomethyl)benzamide |
|
N(C(=O)c1ccc(cc1)Cl)CC#N | 0.0003 |
9 ,
1
