N-[6-(2-hydroxyethyloxy)-5-(3-nitrophenyl)pyrimidin-4-yl]-4-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[6-(2-hydroxyethyloxy)-5-(3-nitrophenyl)pyrimidin-4-yl]-4-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[6-(2-hydroxyethoxy)-5-(3-nitrophenyl)pyrimidin-4-yl]-4-(trifluoromethyl)benzenesulfonamide CAS Name: N-[6-(2-hydroxyethoxy)-5-(3-nitrophenyl)-4-pyrimidinyl]-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[6-(2-hydroxyethoxy)-5-(3-nitrophenyl)pyrimidin-4-yl]-4-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[6-(2-hydroxyethoxy)-5-(3-nitrophenyl)pyrimidin-4-yl]-4-(trifluoromethyl)benzenesulfonamide Formula: C19H15F3N4O6S MolecularWeight: 484.40581

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C(N=CN=C2OCCO)NS(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C(N=CN=C2OCCO)NS(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H15F3N4O6S/c20-19(21,22)13-4-6-15(7-5-13)33(30,31)25-17-16(18(24-11-23-17)32-9-8-27)12-2-1-3-14(10-12)26(28)29/h1-7,10-11,27H,8-9H2,(H,23,24,25)