IUPAC name
S-ethyl N-[3-(dimethylamino)propyl]carbamothioate
SMILES
CCSC(=O)NCCCN(C)C
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
prothiocarb
IUPAC name
S-ethyl N-[3-(dimethylamino)propyl]carbamothioate
SMILES
CCSC(=O)NCCCN(C)C
INCHI
InChI=1S/C8H18N2OS/c1-4-12-8(11)9-6-5-7-10(2)3/h4-7H2,1-3H3,(H,9,11)
FORMULA
C8H18N2OS
Common name
prothiocarb
IUPAC name
S-ethyl N-[3-(dimethylamino)propyl]carbamothioate
Molecular weight
190.306
clogP
1.123
clogS
-1.629
HBond Acceptor
3
HBond Donor
1
Total Polar Surface Area
61.13
Number of Rings
0
Rotatable Bond
6
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00007 | propane |
|
C(C)C | 0.2412 |
| FDBF00064 | N,N-dimethylmethanamine |
|
N(C)(C)C | 0.0371 |
| FDBF00066 | N-methylmethanamine |
|
N(C)C | 0.0914 |
| FDBF00289 | N,N-dimethylethanamine |
|
C(C)N(C)C | 0.0299 |
| FDBF00377 | N,N-dimethylpropan-1-amine |
|
N(C)(C)CCC | 0.0113 |
| FDBF05939 | S-ethyl N-ethylcarbamothioate |
|
N(C(=O)SCC)CC | 0.0010 |
| FDBF06076 | S-ethyl N-methylcarbamothioate |
|
C(C)SC(=O)NC | 0.0010 |
7 ,
1
