IUPAC Name :5-bromo-N-[2-chloro-4-methyl-6-(methylcarbamoyl)phenyl]-2-(3-chloropyridin-2-yl)pyrazole-3-carboxamide
InChI :InChI=1/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)
Std.InChI: InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)
InChIKey :PSOVNZZNOMJUBI-UHFFFAOYAR
Std.InChIKey: PSOVNZZNOMJUBI-UHFFFAOYSA-N
SMILES :O=C(NC)c1cc(Cl)cc(c1NC(=O)c3cc(Br)nn3c2ncccc2Cl)C
MDL: MFCD11840831
Molar Refractivity :112.11 ± 0.5 cm3 (est)
Parachor :795.6 ± 8.0 cm3 (est)
Index of Refraction :1.699 ± 0.05
(est)
Surface Tension :56.4 ± 7.0 dyne/cm (est)
Density :1.66 ± 0.1 g/cm3 (est)
Polarizability :44.44 ± 0.5 10-24cm3 (est)