N-[6-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenyl)sulfanyl-2-pyrimidin-2-yl-pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide

Systemtic Name: N-[6-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenyl)sulfanyl-2-pyrimidin-2-yl-pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide Openeye Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenyl)sulfanyl-2-pyrimidin-2-yl-pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide CAS Name: N-[6-[2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy]-5-[(2-methoxyphenyl)thio]-2-(2-pyrimidinyl)-4-pyrimidinyl]-4-tert-butylbenzenesulfonamide IUPAC Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenyl)sulfanyl-2-pyrimidin-2-ylpyrimidin-4-yl]-4-tert-butylbenzenesulfonamide Traditional Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-[(2-methoxyphenyl)thio]-2-(2-pyrimidyl)pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide Formula: C31H30BrN7O5S2 MolecularWeight: 724.6478

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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)C3=NC=CC=N3)OCCOC4=NC=C(C=N4)Br)SC5=CC=CC=C5OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCOC4=NC=C(C=N4)Br)SC5=CC=CC=C5OC

InChI

InChI=1S/C31H30BrN7O5S2/c1-31(2,3)20-10-12-22(13-11-20)46(40,41)39-26-25(45-24-9-6-5-8-23(24)42-4)29(38-28(37-26)27-33-14-7-15-34-27)43-16-17-44-30-35-18-21(32)19-36-30/h5-15,18-19H,16-17H2,1-4H3,(H,37,38,39)