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

Systemtic Name: 5-bromanyl-N-[1-[4-(4-fluoranylphenoxy)phenyl]propyl]-6-propyl-pyrimidin-4-amine Openeye Name: 5-bromo-N-[1-[4-(4-fluorophenoxy)phenyl]propyl]-6-propyl-pyrimidin-4-amine CAS Name: 5-bromo-N-[1-[4-(4-fluorophenoxy)phenyl]propyl]-6-propyl-4-pyrimidinamine IUPAC Name: 5-bromo-N-[1-[4-(4-fluorophenoxy)phenyl]propyl]-6-propylpyrimidin-4-amine Traditional Name: (5-bromo-6-propyl-pyrimidin-4-yl)-[1-[4-(4-fluorophenoxy)phenyl]propyl]amine Formula: C22H23BrFN3O MolecularWeight: 444.339923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23BrFN3O/c1-3-5-20-21(23)22(26-14-25-20)27-19(4-2)15-6-10-17(11-7-15)28-18-12-8-16(24)9-13-18/h6-14,19H,3-5H2,1-2H3,(H,25,26,27)