N4,N4-dimethyl-N6-(3-phenethylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine

Systemtic Name: N4,N4-dimethyl-N6-(3-phenethylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine Openeye Name: N4,N4-dimethyl-N6-(3-phenethylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine CAS Name: N4,N4-dimethyl-N6-(3-phenethylphenyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dimethyl-6-N-(3-phenethylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine Traditional Name: dimethyl-[6-(3-phenethylanilino)-2-[4-(2-pyrimidyl)piperazino]pyrimidin-4-yl]amine Formula: C28H32N8 MolecularWeight: 480.60728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=C1)NC2=CC=CC(=C2)CCC3=CC=CC=C3)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CN(C)C1=NC(=NC(=C1)NC2=CC=CC(=C2)CCC3=CC=CC=C3)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C28H32N8/c1-34(2)26-21-25(31-24-11-6-10-23(20-24)13-12-22-8-4-3-5-9-22)32-28(33-26)36-18-16-35(17-19-36)27-29-14-7-15-30-27/h3-11,14-15,20-21H,12-13,16-19H2,1-2H3,(H,31,32,33)