Common name
thiophanate-methyl
Formula
C12H14N4O4S2
CAS
23564-05-8
IUPAC name
dimethyl N,N'-[1,2-phenylenebis(azanediylcarbonothioyl)]dicarbamate
SMILES
COC(=NC(=Nc1ccccc1N=C(N=C(O)OC)S)S)O
INCHI
InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)
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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