PROTHIOCONAZOLE

The 3H-1,2,4-Triazole-3-thione,2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1,2-dihydro-, with the CAS registry number 178928-70-6, is also known as Proline fungicide. This chemical's molecular formula is C₁₄H₁₅Cl₂N₃OS and molecular weight is 344.26. What's more, its systematic name is 2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1,2-dihydro-3H-1,2,4-triazole-3-thione. Its classification code is Fungicides. 

Physical properties of 3H-1,2,4-Triazole-3-thione,2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1,2-dihydro- are: (1)ACD/LogP: 1.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.74; (4)ACD/LogD (pH 7.4): 1.77; (5)ACD/BCF (pH 5.5): 12.23; (6)ACD/BCF (pH 7.4): 12.95; (7)ACD/KOC (pH 5.5): 205.5; (8)ACD/KOC (pH 7.4): 217.56; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 60.16 Å²; (13)Index of Refraction: 1.697; (14)Molar Refractivity: 87.92 cm³; (15)Molar Volume: 228 cm³; (16)Polarizability: 34.85×10^-24cm³; (17)Surface Tension: 56.8 dyne/cm; (18)Density: 1.5 g/cm³; (19)Flash Point: 248.2 °C; (20)Enthalpy of Vaporization: 79.26 kJ/mol; (21)Boiling Point: 486.7 °C at 760 mmHg; (22)Vapour Pressure: 2.75E-10 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is toxic to aquatic organisms as it may cause long-term adverse effects in the aquatic environment. You should avoid releasing it to the environment just refering to special instructions/safety data sheet.

You can still convert the following datas into molecular structure:
(1)SMILES: S=C1/N=C\NN1CC(O)(Cc2ccccc2Cl)C3(Cl)CC3
(2)Std. InChI: InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)
(3)Std. InChIKey: MNHVNIJQQRJYDH-UHFFFAOYSA-N