6-[4-(diphenylmethyl)piperazin-1-yl]-N4-(oxolan-2-ylmethyl)pyrimidine-4,5-diamine

Systemtic Name: 6-[4-(diphenylmethyl)piperazin-1-yl]-N4-(oxolan-2-ylmethyl)pyrimidine-4,5-diamine Openeye Name: 6-(4-benzhydrylpiperazin-1-yl)-N4-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5-diamine CAS Name: 6-[4-(diphenylmethyl)-1-piperazinyl]-N4-(2-oxolanylmethyl)pyrimidine-4,5-diamine IUPAC Name: 6-(4-benzhydrylpiperazin-1-yl)-4-N-(oxolan-2-ylmethyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-benzhydrylpiperazino)pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C26H32N6O MolecularWeight: 444.57188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC=NC(=C2N)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CNC2=NC=NC(=C2N)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H32N6O/c27-23-25(28-18-22-12-7-17-33-22)29-19-30-26(23)32-15-13-31(14-16-32)24(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-6,8-11,19,22,24H,7,12-18,27H2,(H,28,29,30)