N-[6-(2-hydroxyethyloxy)-5-(4-methylphenyl)pyrimidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[6-(2-hydroxyethyloxy)-5-(4-methylphenyl)pyrimidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[6-(2-hydroxyethoxy)-5-(p-tolyl)pyrimidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[6-(2-hydroxyethoxy)-5-(4-methylphenyl)-4-pyrimidinyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[6-(2-hydroxyethoxy)-5-(4-methylphenyl)pyrimidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[6-(2-hydroxyethoxy)-5-(p-tolyl)pyrimidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide Formula: C20H18F3N3O4S MolecularWeight: 453.43483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=CN=C2OCCO)NS(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=CN=C2OCCO)NS(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H18F3N3O4S/c1-13-6-8-14(9-7-13)17-18(24-12-25-19(17)30-11-10-27)26-31(28,29)16-5-3-2-4-15(16)20(21,22)23/h2-9,12,27H,10-11H2,1H3,(H,24,25,26)