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1-[4-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]phenyl]-3-[2-(trifluoromethyl)phenyl]urea
1-[4-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]phenyl]-3-[2-(trifluoromethyl)phenyl]urea
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC(=NC(=N1)CSC2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3C(F)(F)F)OC
Isomeric SMILES
COC1=CC(=NC(=N1)CSC2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3C(F)(F)F)OC
InChI
InChI=1S/C21H19F3N4O3S/c1-30-18-11-19(31-2)28-17(27-18)12-32-14-9-7-13(8-10-14)25-20(29)26-16-6-4-3-5-15(16)21(22,23)24/h3-11H,12H2,1-2H3,(H2,25,26,29)
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