6-(5-bromanylpyridin-3-yl)-N-(4-methoxyphenyl)-2-phenyl-pyrimidin-4-amine

Systemtic Name: 6-(5-bromanylpyridin-3-yl)-N-(4-methoxyphenyl)-2-phenyl-pyrimidin-4-amine Openeye Name: 6-(5-bromo-3-pyridyl)-N-(4-methoxyphenyl)-2-phenyl-pyrimidin-4-amine CAS Name: 6-(5-bromo-3-pyridinyl)-N-(4-methoxyphenyl)-2-phenyl-4-pyrimidinamine IUPAC Name: 6-(5-bromopyridin-3-yl)-N-(4-methoxyphenyl)-2-phenylpyrimidin-4-amine Traditional Name: [6-(5-bromo-3-pyridyl)-2-phenyl-pyrimidin-4-yl]-(4-methoxyphenyl)amine Formula: C22H17BrN4O MolecularWeight: 433.30058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=NC(=C2)C3=CC(=CN=C3)Br)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=NC(=C2)C3=CC(=CN=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H17BrN4O/c1-28-19-9-7-18(8-10-19)25-21-12-20(16-11-17(23)14-24-13-16)26-22(27-21)15-5-3-2-4-6-15/h2-14H,1H3,(H,25,26,27)