Common name
buthiobate
Formula
C21H28N2S2
CAS
51308-54-4
IUPAC name
butyl [4-(1,1-dimethylethyl)phenyl]methyl N-3-pyridinylcarbonimidodithioate
SMILES
CCCCSC(=Nc1cccnc1)SCc1ccc(cc1)C(C)(C)C
INCHI
InChI=1S/C21H28N2S2/c1-5-6-14-24-20(23-19-8-7-13-22-15-19)25-16-17-9-11-18(12-10-17)21(2,3)4/h7-13,15H,5-6,14,16H2,1-4H3
Physicochemical Properties
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Lipophilicity
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Water Solubility
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Geometric
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Electrostatic
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Flexibility
Num. Rot. bonds: 9
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AgroPAD
Photostability
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Topological
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Fungicide-likeness scores
The higher the score, the better the fungicide-likeness
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