3-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-4-tert-butyl-5-(2-methoxyphenoxy)-2-(2-methylsulfanylpyrimidin-4-yl)benzenesulfonamide

Systemtic Name: 3-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-4-tert-butyl-5-(2-methoxyphenoxy)-2-(2-methylsulfanylpyrimidin-4-yl)benzenesulfonamide Openeye Name: 3-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-4-tert-butyl-5-(2-methoxyphenoxy)-2-(2-methylsulfanylpyrimidin-4-yl)benzenesulfonamide CAS Name: 3-[2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy]-4-tert-butyl-5-(2-methoxyphenoxy)-2-[2-(methylthio)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 3-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-4-tert-butyl-5-(2-methoxyphenoxy)-2-(2-methylsulfanylpyrimidin-4-yl)benzenesulfonamide Traditional Name: 3-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-4-tert-butyl-5-(2-methoxyphenoxy)-2-[2-(methylthio)pyrimidin-4-yl]benzenesulfonamide Formula: C28H30BrN5O6S2 MolecularWeight: 676.6017

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(C=C1OC2=CC=CC=C2OC)S(=O)(=O)N)C3=NC(=NC=C3)SC)OCCOC4=NC=C(C=N4)Br

Isomeric SMILES

CC(C)(C)C1=C(C(=C(C=C1OC2=CC=CC=C2OC)S(=O)(=O)N)C3=NC(=NC=C3)SC)OCCOC4=NC=C(C=N4)Br

InChI

InChI=1S/C28H30BrN5O6S2/c1-28(2,3)24-21(40-20-9-7-6-8-19(20)37-4)14-22(42(30,35)36)23(18-10-11-31-27(34-18)41-5)25(24)38-12-13-39-26-32-15-17(29)16-33-26/h6-11,14-16H,12-13H2,1-5H3,(H2,30,35,36)