4-tert-butyl-N-[6-(2-hydroxyethylsulfanyl)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[6-(2-hydroxyethylsulfanyl)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[6-(2-hydroxyethylsulfanyl)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[6-(2-hydroxyethylthio)-5-(3-methoxyphenoxy)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[6-(2-hydroxyethylsulfanyl)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-(2-hydroxyethylthio)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide Formula: C23H27N3O5S2 MolecularWeight: 489.60758

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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)SCCO)OC3=CC(=CC=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O5S2/c1-23(2,3)16-8-10-19(11-9-16)33(28,29)26-21-20(22(25-15-24-21)32-13-12-27)31-18-7-5-6-17(14-18)30-4/h5-11,14-15,27H,12-13H2,1-4H3,(H,24,25,26)