5-bromanyl-N-[1-[4-(4-fluoranylphenoxy)phenyl]propyl]-2-methyl-6-propyl-pyrimidin-4-amine

Systemtic Name: 5-bromanyl-N-[1-[4-(4-fluoranylphenoxy)phenyl]propyl]-2-methyl-6-propyl-pyrimidin-4-amine Openeye Name: 5-bromo-N-[1-[4-(4-fluorophenoxy)phenyl]propyl]-2-methyl-6-propyl-pyrimidin-4-amine CAS Name: 5-bromo-N-[1-[4-(4-fluorophenoxy)phenyl]propyl]-2-methyl-6-propyl-4-pyrimidinamine IUPAC Name: 5-bromo-N-[1-[4-(4-fluorophenoxy)phenyl]propyl]-2-methyl-6-propylpyrimidin-4-amine Traditional Name: (5-bromo-2-methyl-6-propyl-pyrimidin-4-yl)-[1-[4-(4-fluorophenoxy)phenyl]propyl]amine Formula: C23H25BrFN3O MolecularWeight: 458.366503

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NC(=N1)C)NC(CC)C2=CC=C(C=C2)OC3=CC=C(C=C3)F)Br

Isomeric SMILES

CCCC1=C(C(=NC(=N1)C)NC(CC)C2=CC=C(C=C2)OC3=CC=C(C=C3)F)Br

InChI

InChI=1S/C23H25BrFN3O/c1-4-6-21-22(24)23(27-15(3)26-21)28-20(5-2)16-7-11-18(12-8-16)29-19-13-9-17(25)10-14-19/h7-14,20H,4-6H2,1-3H3,(H,26,27,28)