5-bromanyl-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-[4-(3-morpholin-4-ylpropoxy)phenyl]pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-[4-(3-morpholin-4-ylpropoxy)phenyl]pyrimidine-2,4-diamine Openeye Name: 5-bromo-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-[4-(3-morpholinopropoxy)phenyl]pyrimidine-2,4-diamine CAS Name: 5-bromo-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-[4-[3-(4-morpholinyl)propoxy]phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[4-(3-morpholin-4-ylpropoxy)phenyl]pyrimidine-2,4-diamine Traditional Name: [5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-[4-(3-morpholinopropoxy)phenyl]amine Formula: C23H28BrN7O2 MolecularWeight: 514.41812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)OCCCN5CCOCC5

Isomeric SMILES

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)OCCCN5CCOCC5

InChI

InChI=1S/C23H28BrN7O2/c24-19-15-25-23(28-22(19)27-21-14-20(29-30-21)16-2-3-16)26-17-4-6-18(7-5-17)33-11-1-8-31-9-12-32-13-10-31/h4-7,14-16H,1-3,8-13H2,(H3,25,26,27,28,29,30)