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

Systemtic Name: 4-tert-butyl-N-[5-(2-methoxyphenoxy)-6-(4-oxidanylbut-2-ynoxy)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[6-(4-hydroxybut-2-ynoxy)-5-(2-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[6-(4-hydroxybut-2-ynoxy)-5-(2-methoxyphenoxy)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[6-(4-hydroxybut-2-ynoxy)-5-(2-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-(4-hydroxybut-2-ynoxy)-5-(2-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide Formula: C25H27N3O6S MolecularWeight: 497.56338

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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)OCC#CCO)OC3=CC=CC=C3OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCC#CCO)OC3=CC=CC=C3OC

InChI

InChI=1S/C25H27N3O6S/c1-25(2,3)18-11-13-19(14-12-18)35(30,31)28-23-22(34-21-10-6-5-9-20(21)32-4)24(27-17-26-23)33-16-8-7-15-29/h5-6,9-14,17,29H,15-16H2,1-4H3,(H,26,27,28)