4-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-3-(2-pyrimidin-2-ylpyrimidin-4-yl)thiophene-2-sulfonamide

Systemtic Name: 4-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-3-(2-pyrimidin-2-ylpyrimidin-4-yl)thiophene-2-sulfonamide Openeye Name: 4-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-3-(2-pyrimidin-2-ylpyrimidin-4-yl)thiophene-2-sulfonamide CAS Name: 4-[2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy]-5-(2-methoxyphenoxy)-3-[2-(2-pyrimidinyl)-4-pyrimidinyl]-2-thiophenesulfonamide IUPAC Name: 4-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-3-(2-pyrimidin-2-ylpyrimidin-4-yl)thiophene-2-sulfonamide Traditional Name: 4-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-3-[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(C(=C(S2)S(=O)(=O)N)C3=NC(=NC=C3)C4=NC=CC=N4)OCCOC5=NC=C(C=N5)Br

Isomeric SMILES

COC1=CC=CC=C1OC2=C(C(=C(S2)S(=O)(=O)N)C3=NC(=NC=C3)C4=NC=CC=N4)OCCOC5=NC=C(C=N5)Br

InChI

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