niazidin

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IUPAC Name :O-cyano N-[[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]methyl]carbamothioate
InChI :InChI=1/C15H18N2O6S/c1-8-11(18)12(19)13(20)14(22-8)23-10-4-2-9(3-5-10)6-17-15(24)21-7-16/h2-5,8,11-14,18-20H,6H2,1H3,(H,17,24)/t8-,11-,12+,13+,14-/m0/s1
Std.InChI: InChI=1S/C15H18N2O6S/c1-8-11(18)12(19)13(20)14(22-8)23-10-4-2-9(3-5-10)6-17-15(24)21-7-16/h2-5,8,11-14,18-20H,6H2,1H3,(H,17,24)/t8-,11-,12+,13+,14-/m0/s1
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InChIKey :NYQKSLDPYVPTRT-CNJBRALLBX
Std.InChIKey: NYQKSLDPYVPTRT-CNJBRALLSA-N
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SMILES :C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=CC=C(C=C2)CNC(=S)OC#N)O)O)O
Molar Refractivity :85.40 ± 0.5 cm3 (est)
Parachor :646.6 ± 8.0 cm3 (est)
Index of Refraction :1.637 ± 0.05 (est)
Surface Tension :54.7 ± 7.0 dyne/cm (est)
Density :1.49 ± 0.1 g/cm3 (est)
Polarizability :33.85 ± 0.5 10-24cm3 (est)