4-tert-butyl-N-[6-(2-hydroxyethyloxy)-5-phenoxy-pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[6-(2-hydroxyethyloxy)-5-phenoxy-pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-phenoxy-pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-phenoxy-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-phenoxypyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-phenoxy-pyrimidin-4-yl]benzenesulfonamide Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCO)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCO)OC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O5S/c1-22(2,3)16-9-11-18(12-10-16)31(27,28)25-20-19(30-17-7-5-4-6-8-17)21(24-15-23-20)29-14-13-26/h4-12,15,26H,13-14H2,1-3H3,(H,23,24,25)