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

Systemtic Name: 1,3-dimethyl-8-[2-(4-phenylpiperazin-1-yl)ethyl]purino[7,8-a]pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-8-[2-(4-phenylpiperazin-1-yl)ethyl]purino[7,8-a]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-8-[2-(4-phenyl-1-piperazinyl)ethyl]purino[7,8-a]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-8-[2-(4-phenylpiperazin-1-yl)ethyl]purino[7,8-a]pyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-8-[2-(4-phenylpiperazino)ethyl]purino[7,8-a]pyrimidine-2,4-quinone Formula: C22H25N7O2 MolecularWeight: 419.4796

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=CC(=NC3=N2)CCN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=CC(=NC3=N2)CCN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C22H25N7O2/c1-25-19-18(20(30)26(2)22(25)31)29-11-9-16(23-21(29)24-19)8-10-27-12-14-28(15-13-27)17-6-4-3-5-7-17/h3-7,9,11H,8,10,12-15H2,1-2H3