N-[6-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[6-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]thiophene-2-sulfonamide CAS Name: N-[6-[2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy]-5-(2-methoxyphenoxy)-2-(2-pyrimidinyl)-4-pyrimidinyl]-2-thiophenesulfonamide IUPAC Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-2-(2-pyrimidyl)pyrimidin-4-yl]thiophene-2-sulfonamide Formula: C25H20BrN7O6S2 MolecularWeight: 658.5036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=C(N=C(N=C2OCCOC3=NC=C(C=N3)Br)C4=NC=CC=N4)NS(=O)(=O)C5=CC=CS5

Isomeric SMILES

COC1=CC=CC=C1OC2=C(N=C(N=C2OCCOC3=NC=C(C=N3)Br)C4=NC=CC=N4)NS(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C25H20BrN7O6S2/c1-36-17-6-2-3-7-18(17)39-20-21(33-41(34,35)19-8-4-13-40-19)31-23(22-27-9-5-10-28-22)32-24(20)37-11-12-38-25-29-14-16(26)15-30-25/h2-10,13-15H,11-12H2,1H3,(H,31,32,33)