N1-(5-bromanyl-4-pyridin-4-yl-pyrimidin-2-yl)-3-phenyl-propane-1,2-diamine

Systemtic Name: N1-(5-bromanyl-4-pyridin-4-yl-pyrimidin-2-yl)-3-phenyl-propane-1,2-diamine Openeye Name: N1-[5-bromo-4-(4-pyridyl)pyrimidin-2-yl]-3-phenyl-propane-1,2-diamine CAS Name: N1-(5-bromo-4-pyridin-4-yl-2-pyrimidinyl)-3-phenylpropane-1,2-diamine IUPAC Name: 1-N-(5-bromo-4-pyridin-4-ylpyrimidin-2-yl)-3-phenylpropane-1,2-diamine Traditional Name: (2-amino-3-phenyl-propyl)-[5-bromo-4-(4-pyridyl)pyrimidin-2-yl]amine Formula: C18H18BrN5 MolecularWeight: 384.27302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CNC2=NC=C(C(=N2)C3=CC=NC=C3)Br)N

Isomeric SMILES

C1=CC=C(C=C1)CC(CNC2=NC=C(C(=N2)C3=CC=NC=C3)Br)N

InChI

InChI=1S/C18H18BrN5/c19-16-12-23-18(24-17(16)14-6-8-21-9-7-14)22-11-15(20)10-13-4-2-1-3-5-13/h1-9,12,15H,10-11,20H2,(H,22,23,24)