2-(2-hydroxyethyloxy)-4-methylsulfanyl-3-[5-(phenylmethyl)-2-(trifluoromethyl)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 2-(2-hydroxyethyloxy)-4-methylsulfanyl-3-[5-(phenylmethyl)-2-(trifluoromethyl)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 3-[5-benzyl-2-(trifluoromethyl)pyrimidin-4-yl]-2-(2-hydroxyethoxy)-4-methylsulfanyl-benzenesulfonamide CAS Name: 2-(2-hydroxyethoxy)-4-(methylthio)-3-[5-(phenylmethyl)-2-(trifluoromethyl)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 3-[5-benzyl-2-(trifluoromethyl)pyrimidin-4-yl]-2-(2-hydroxyethoxy)-4-methylsulfanylbenzenesulfonamide Traditional Name: 3-[5-benzyl-2-(trifluoromethyl)pyrimidin-4-yl]-2-(2-hydroxyethoxy)-4-(methylthio)benzenesulfonamide Formula: C21H20F3N3O4S2 MolecularWeight: 499.52641

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=C(C=C1)S(=O)(=O)N)OCCO)C2=NC(=NC=C2CC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CSC1=C(C(=C(C=C1)S(=O)(=O)N)OCCO)C2=NC(=NC=C2CC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O4S2/c1-32-15-7-8-16(33(25,29)30)19(31-10-9-28)17(15)18-14(11-13-5-3-2-4-6-13)12-26-20(27-18)21(22,23)24/h2-8,12,28H,9-11H2,1H3,(H2,25,29,30)