9-[3-(4-phenylpiperazin-1-yl)propyl]-1-(2-phenylpropan-2-yl)-6H-purin-6-amine

Systemtic Name: 9-[3-(4-phenylpiperazin-1-yl)propyl]-1-(2-phenylpropan-2-yl)-6H-purin-6-amine Openeye Name: 1-(1-methyl-1-phenyl-ethyl)-9-[3-(4-phenylpiperazin-1-yl)propyl]-6H-purin-6-amine CAS Name: 9-[3-(4-phenyl-1-piperazinyl)propyl]-1-(2-phenylpropan-2-yl)-6H-purin-6-amine IUPAC Name: 9-[3-(4-phenylpiperazin-1-yl)propyl]-1-(2-phenylpropan-2-yl)-6H-purin-6-amine Traditional Name: [1-cumyl-9-[3-(4-phenylpiperazino)propyl]-6H-purin-6-yl]amine Formula: C27H35N7 MolecularWeight: 457.6137

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)N2C=NC3=C(C2N)N=CN3CCCN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C1=CC=CC=C1)N2C=NC3=C(C2N)N=CN3CCCN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H35N7/c1-27(2,22-10-5-3-6-11-22)34-21-30-26-24(25(34)28)29-20-33(26)15-9-14-31-16-18-32(19-17-31)23-12-7-4-8-13-23/h3-8,10-13,20-21,25H,9,14-19,28H2,1-2H3