3-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-1-(2-pyrimidin-2-ylpyrimidin-4-yl)naphthalene-2-sulfonamide

Systemtic Name: 3-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-1-(2-pyrimidin-2-ylpyrimidin-4-yl)naphthalene-2-sulfonamide Openeye Name: 3-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-1-(2-pyrimidin-2-ylpyrimidin-4-yl)naphthalene-2-sulfonamide CAS Name: 3-[2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy]-5-(2-methoxyphenoxy)-1-[2-(2-pyrimidinyl)-4-pyrimidinyl]-2-naphthalenesulfonamide IUPAC Name: 3-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-1-(2-pyrimidin-2-ylpyrimidin-4-yl)naphthalene-2-sulfonamide Traditional Name: 3-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(2-methoxyphenoxy)-1-[2-(2-pyrimidyl)pyrimidin-4-yl]naphthalene-2-sulfonamide Formula: C31H24BrN7O6S MolecularWeight: 702.53456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=CC=CC3=C(C(=C(C=C32)OCCOC4=NC=C(C=N4)Br)S(=O)(=O)N)C5=NC(=NC=C5)C6=NC=CC=N6

Isomeric SMILES

COC1=CC=CC=C1OC2=CC=CC3=C(C(=C(C=C32)OCCOC4=NC=C(C=N4)Br)S(=O)(=O)N)C5=NC(=NC=C5)C6=NC=CC=N6

InChI

InChI=1S/C31H24BrN7O6S/c1-42-24-7-2-3-8-25(24)45-23-9-4-6-20-21(23)16-26(43-14-15-44-31-37-17-19(32)18-38-31)28(46(33,40)41)27(20)22-10-13-36-30(39-22)29-34-11-5-12-35-29/h2-13,16-18H,14-15H2,1H3,(H2,33,40,41)