IUPAC Name :2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methanesulfonamidomethyl)benzoic acid
InChI :InChI=1/C16H19N5O9S2/c1-29-12-7-13(30-2)19-15(18-12)20-16(24)21-32(27,28)11-6-9(8-17-31(3,25)26)4-5-10(11)14(22)23/h4-7,17H,8H2,1-3H3,(H,22,23)(H2,18,19,20,21,24)
Std.InChI: InChI=1S/C16H19N5O9S2/c1-29-12-7-13(30-2)19-15(18-12)20-16(24)21-32(27,28)11-6-9(8-17-31(3,25)26)4-5-10(11)14(22)23/h4-7,17H,8H2,1-3H3,(H,22,23)(H2,18,19,20,21,24)
InChIKey :MAYMYMXYWIVVOK-UHFFFAOYAG
Std.InChIKey: MAYMYMXYWIVVOK-UHFFFAOYSA-N
SMILES :COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC(=C2)CNS(=O)(=O)C)C(=O)O)OC
Molar Refractivity :110.74 ± 0.5 cm3 (est)
Parachor :856.3 ± 8.0 cm3 (est)
Index of Refraction :1.662 ± 0.05
(est)
Surface Tension :67.0 ± 7.0 dyne/cm (est)
Density :1.63 ± 0.1 g/cm3 (est)
Polarizability :43.90 ± 0.5 10-24cm3 (est)