1,3-dimethyl-8-[3-(4-phenylpiperazin-1-yl)propylamino]purino[7,8-a]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-8-[3-(4-phenylpiperazin-1-yl)propylamino]purino[7,8-a]pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-8-[3-(4-phenylpiperazin-1-yl)propylamino]purino[7,8-a]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-8-[3-(4-phenyl-1-piperazinyl)propylamino]purino[7,8-a]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-8-[3-(4-phenylpiperazin-1-yl)propylamino]purino[7,8-a]pyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-8-[3-(4-phenylpiperazino)propylamino]purino[7,8-a]pyrimidine-2,4-quinone Formula: C23H28N8O2 MolecularWeight: 448.52082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=CC(=NC3=N2)NCCCN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=CC(=NC3=N2)NCCCN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C23H28N8O2/c1-27-20-19(21(32)28(2)23(27)33)31-12-9-18(25-22(31)26-20)24-10-6-11-29-13-15-30(16-14-29)17-7-4-3-5-8-17/h3-5,7-9,12H,6,10-11,13-16H2,1-2H3,(H,24,25,26)