N-(5-bromanyl-6-pyridin-4-yl-pyridin-2-yl)-2,2-dimethyl-1-phenyl-propane-1,3-diamine

Systemtic Name: N-(5-bromanyl-6-pyridin-4-yl-pyridin-2-yl)-2,2-dimethyl-1-phenyl-propane-1,3-diamine Openeye Name: N-[5-bromo-6-(4-pyridyl)-2-pyridyl]-2,2-dimethyl-1-phenyl-propane-1,3-diamine CAS Name: N-(5-bromo-6-pyridin-4-yl-2-pyridinyl)-2,2-dimethyl-1-phenylpropane-1,3-diamine IUPAC Name: N-(5-bromo-6-pyridin-4-ylpyridin-2-yl)-2,2-dimethyl-1-phenylpropane-1,3-diamine Traditional Name: (3-amino-2,2-dimethyl-1-phenyl-propyl)-[5-bromo-6-(4-pyridyl)-2-pyridyl]amine Formula: C21H23BrN4 MolecularWeight: 411.33812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrN4/c1-21(2,14-23)20(16-6-4-3-5-7-16)26-18-9-8-17(22)19(25-18)15-10-12-24-13-11-15/h3-13,20H,14,23H2,1-2H3,(H,25,26)