N-[6-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(4-methylphenyl)-2-pyrimidin-2-yl-pyrimidin-4-yl]-2-phenyl-ethanesulfonamide

Systemtic Name: N-[6-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(4-methylphenyl)-2-pyrimidin-2-yl-pyrimidin-4-yl]-2-phenyl-ethanesulfonamide Openeye Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(p-tolyl)-2-pyrimidin-2-yl-pyrimidin-4-yl]-2-phenyl-ethanesulfonamide CAS Name: N-[6-[2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy]-5-(4-methylphenyl)-2-(2-pyrimidinyl)-4-pyrimidinyl]-2-phenylethanesulfonamide IUPAC Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(4-methylphenyl)-2-pyrimidin-2-ylpyrimidin-4-yl]-2-phenylethanesulfonamide Traditional Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(p-tolyl)-2-(2-pyrimidyl)pyrimidin-4-yl]-2-phenyl-ethanesulfonamide Formula: C29H26BrN7O4S MolecularWeight: 648.53024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(N=C2OCCOC3=NC=C(C=N3)Br)C4=NC=CC=N4)NS(=O)(=O)CCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(N=C2OCCOC3=NC=C(C=N3)Br)C4=NC=CC=N4)NS(=O)(=O)CCC5=CC=CC=C5

InChI

InChI=1S/C29H26BrN7O4S/c1-20-8-10-22(11-9-20)24-25(37-42(38,39)17-12-21-6-3-2-4-7-21)35-27(26-31-13-5-14-32-26)36-28(24)40-15-16-41-29-33-18-23(30)19-34-29/h2-11,13-14,18-19H,12,15-17H2,1H3,(H,35,36,37)