N-[5-(phenylcarbonyl)-2-(trifluoromethyl)pyrimidin-4-yl]-4-propan-2-yloxy-benzenesulfonamide

Systemtic Name: N-[5-(phenylcarbonyl)-2-(trifluoromethyl)pyrimidin-4-yl]-4-propan-2-yloxy-benzenesulfonamide Openeye Name: N-[5-benzoyl-2-(trifluoromethyl)pyrimidin-4-yl]-4-isopropoxy-benzenesulfonamide CAS Name: N-[5-benzoyl-2-(trifluoromethyl)-4-pyrimidinyl]-4-propan-2-yloxybenzenesulfonamide IUPAC Name: N-[5-benzoyl-2-(trifluoromethyl)pyrimidin-4-yl]-4-propan-2-yloxybenzenesulfonamide Traditional Name: N-[5-benzoyl-2-(trifluoromethyl)pyrimidin-4-yl]-4-isopropoxy-benzenesulfonamide Formula: C21H18F3N3O4S MolecularWeight: 465.44553

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=NC=C2C(=O)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=NC=C2C(=O)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O4S/c1-13(2)31-15-8-10-16(11-9-15)32(29,30)27-19-17(12-25-20(26-19)21(22,23)24)18(28)14-6-4-3-5-7-14/h3-13H,1-2H3,(H,25,26,27)