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

Systemtic Name: 3-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(4-methylphenyl)-1-pyrimidin-4-yl-naphthalene-2-sulfonamide Openeye Name: 3-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(p-tolyl)-1-pyrimidin-4-yl-naphthalene-2-sulfonamide CAS Name: 3-[2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy]-5-(4-methylphenyl)-1-(4-pyrimidinyl)-2-naphthalenesulfonamide IUPAC Name: 3-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(4-methylphenyl)-1-pyrimidin-4-ylnaphthalene-2-sulfonamide Traditional Name: 3-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(p-tolyl)-1-(4-pyrimidyl)naphthalene-2-sulfonamide Formula: C27H22BrN5O4S MolecularWeight: 592.46368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC3=C(C(=C(C=C32)OCCOC4=NC=C(C=N4)Br)S(=O)(=O)N)C5=NC=NC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC3=C(C(=C(C=C32)OCCOC4=NC=C(C=N4)Br)S(=O)(=O)N)C5=NC=NC=C5

InChI

InChI=1S/C27H22BrN5O4S/c1-17-5-7-18(8-6-17)20-3-2-4-21-22(20)13-24(36-11-12-37-27-31-14-19(28)15-32-27)26(38(29,34)35)25(21)23-9-10-30-16-33-23/h2-10,13-16H,11-12H2,1H3,(H2,29,34,35)